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10967/123 - QDB Compounds

QsarDB Repository

Saldana, D. A.; Starck, L.; Mougin, P.; Rousseau, B.; Pidol, L.; Jeuland, N.; Creton, B. Flash Point and Cetane Number Predictions for Fuel Compounds Using Quantitative Structure Property Relationship (QSPR) Methods. Energy Fuels 2011, 25, 9, 3900–3908.

631 compounds | Property FP: Flash point [K]

ID Name FP Details
1 (2E)-but-2-ene-1,4-diol 401.15 View
2 (2R,3R,4R,5S)-hexane-1,2,3,4,5,6-hexol 422 View
3 (2S)-butane-1,2,4-triol 385 View
4 (2Z)-but-2-ene-1,4-diol 401.15 View
9 2-butyl-2-ethylpropane-1,3-diol 386 View
10 2-butyloctan-1-ol 382.15 View
11 2-ethylbutan-1-ol 330 View
12 2-ethylhexan-1-ol 346 View
13 2-ethylhexane-1,3-diol 409 View
14 2-methylbutan-1-ol 316.15 View
15 2-methylbutan-2-ol 294 View
20 2-methylpentan-1-ol 319 View
22 2-methylpentane-2,4-diol 366 View
23 2-methylpropan-1-ol 301 View
24 2-methylpropan-2-ol 284.26 View
25 2,2-bis(hydroxymethyl)propane-1,3-diol 533.15 View
26 2,2-diethylpropane-1,3-diol 374.15 View
27 2,2-dimethylpropane-1,3-diol 371.15 View
28 2,2,4-trimethylpentan-1-ol 329.75 View
29 2,2,4-trimethylpentane-1,3-diol 383.15 View
30 2,3-dimethylbutane-2,3-diol 350 View
31 2,3,4-trimethylpentan-1-ol 333 View
32 2,4,4-trimethylpentan-1-ol 333.15 View
35 3-methylbutan-1-ol 316 View
36 3-methylbutan-2-ol 299.15 View
38 3-methylheptan-3-ol 327 View
42 3-methylpentan-1-ol 331.15 View
43 3-methylpentan-3-ol 297.15 View
44 3,3-dimethylbutan-1-ol 321.15 View
45 4-methylpentan-2-ol 314 View
46 5-methylheptan-3-ol 327 View
47 8-methylnonan-1-ol 377.59 View
48 butan-1-ol 310 View
49 butan-2-ol 296.15 View
51 butane-1,2-diol 363.15 View
52 butane-1,3-diol 382 View
53 butane-1,4-diol 407.15 View
54 butane-2,3-diol 358.15 View
55 decan-1-ol 378 View
67 ethane-1,2-diol 383.15 View
68 ethanol 286 View
73 heptan-1-ol 346 View
74 heptan-2-ol 332.15 View
81 hexan-1-ol 335.15 View
82 hexan-2-ol 314 View
84 hexane-1,2,6-triol 471 View
85 hexane-1,6-diol 420.15 View
86 hexane-2,5-diol 374 View
87 methanol 284 View
92 nonan-1-ol 353 View
96 oct-1-en-3-ol 341 View
101 octan-1-ol 354 View
102 octan-2-ol 358 View
109 pentan-1-ol 330 View
110 pentan-2-ol 314 View
111 pentan-3-ol 313 View
116 pentane-1,5-diol 402.15 View
117 pentane-2,4-diol 374.15 View
118 prop-2-en-1-ol 294 View
119 propan-1-ol 298 View
120 propan-2-ol 285.15 View
121 propane-1,1-diol 372 View
122 propane-1,2-diol 372 View
123 propane-1,2,3-triol 433.15 View
124 propane-1,3-diol 352.15 View
125 tetradecan-1-ol 418 View
129 tridecan-1-ol 394 View
137 (1-methylheptyl)benzene 373 View
138 (1E)-prop-1-en-1-ylbenzene 325.15 View
139 (1Z)-prop-1-enylbenzene 311 View
140 (2-methylbutyl)benzene 337 View
141 (2,2-dimethylpropyl)benzene 323 View
149 1-ethyl-2-isopropylbenzene 331 View
150 1-ethyl-2-methylbenzene 312.15 View
151 1-ethyl-2,3-dimethylbenzene 338 View
152 1-ethyl-2,4-dimethylbenzene 330 View
153 1-ethyl-3-methylbenzene 311.15 View
155 1-ethyl-4-methylbenzene 309.15 View
159 1-methyl-2-ethenylbenzene 320.15 View
160 1-methyl-3-(propan-2-yl)benzene 323 View
161 1-methyl-3-ethenylbenzene 324.15 View
162 1-methyl-3-propylbenzene 325 View
164 1-methyl-4-ethenylbenzene 319 View
169 1,1-diphenylethane 402.04 View
170 1,2-diethylbenzene 330.37 View
171 1,2-dimethyl-3-propylbenzene 345 View
172 1,2-dimethylbenzene 290 View
173 1,2-diphenylbenzene 436 View
174 1,2-diphenylethane 402.04 View
175 1,2,3-trimethylbenzene 317.15 View
176 1,2,3,4-tetramethylbenzene 341.15 View
177 1,2,3,5-tetramethylbenzene 336.48 View
178 1,2,4-triethylbenzene 353.15 View
180 1,2,4-trimethylbenzene 318.65 View
181 1,2,4,5-tetramethylbenzene 328 View
182 1,3-di(propan-2-yl)benzene 349 View
184 1,3-diethylbenzene 329 View
185 1,3-diphenylbenzene 464 View
186 1,3-xylene 298.15 View
187 1,3,5-triethylbenzene 354.15 View
188 1,3,5-triisopropylbenzene 359.82 View
189 1,3,5-trimethylbenzene 317.55 View
190 1,4-diethylbenzene 329.15 View
191 1,4-diisopropylbenzene 349 View
192 1,4-dimethylbenzene 298.15 View
194 1,4-diphenylbenzene 480 View
195 2-ethyl-1,4-dimethylbenzene 329 View
203 2-phenyl-2-methylbutane 338 View
207 2,2-diphenylpropane 383.15 View
216 4-ethyl-1,2-dimethylbenzene 331 View
217 4-isopropyltoluene 320 View
228 alpha-methylstyrene 313.15 View
229 benzene 262 View
230 biphenyl 386 View
232 cyclohexylbenzene 372 View
233 diphenylmethane 403.15 View
235 ethenylbenzene 305 View
236 ethylbenzene 288.15 View
239 indane 321.65 View
240 isobutylbenzene 325.15 View
241 isopentylbenzene 335 View
242 isopropylbenzene 304.15 View
243 n-butylbenzene 323.15 View
244 n-decylbenzene 380 View
245 n-dodecylbenzene 414 View
246 n-heptylbenzene 368.15 View
247 n-hexylbenzene 353.15 View
248 n-propylbenzene 303.15 View
249 n-undecylbenzene 417 View
251 nonylbenzene 372 View
253 octylbenzene 380.15 View
257 pentamethylbenzene 364.15 View
258 pentylbenzene 338.15 View
264 sec-butylbenzene 325 View
265 tert-butylbenzene 333.15 View
268 tetralin 350 View
269 toluene 277.15 View
271 (1R)-1-phenylethan-1-ol 358.15 View
272 (2-methylphenyl)methanol 377.15 View
273 (3-methylphenyl)methanol 378.15 View
274 [4-(hydroxymethyl)phenyl]methanol 461 View
275 {4-[(benzoyloxy)methyl]cyclohexyl}methyl benzoate 434 View
276 1-phenylpropan-1-ol 363.15 View
277 1-phenylpropan-2-ol 358.15 View
278 2-ethylphenol 351.15 View
279 2-furylmethanol 356 View
280 2-methylphenol 354 View
281 2-phenylethanol 369 View
282 2-phenylpropan-1-ol 366.15 View
283 2-phenylpropan-2-ol 360.15 View
284 2,6-di-tert-butyl-p-cresol 390.15 View
285 3-ethylphenol 367.15 View
286 3-methylphenol 368 View
287 3-phenylpropan-1-ol 373.15 View
288 4-(2-methylbutan-2-yl)phenol 384 View
289 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol 480.15 View
290 4-ethylphenol 373.15 View
291 4-methylphenol 368 View
292 4-tert-butylbenzene-1,2-diol 403 View
293 4-tert-butylphenol 386 View
294 benzene-1,2-diol 400 View
295 benzene-1,3-diol 400 View
296 benzene-1,4-diol 438 View
297 benzyl benzoate 418.15 View
298 benzyl ethanoate 363.15 View
299 benzyl methanoate 355 View
300 butyl benzoate 379.15 View
301 di-n-butyl phthalate 430.15 View
302 di-n-decyl phthalate 505 View
303 di-n-hexyl phthalate 466.15 View
304 di-n-nonyl phthalate 489.15 View
305 diethyl phthalate 390.37 View
306 diisobutyl phthalate 434.15 View
307 diisodecyl phthalate 505.37 View
308 dimethyl isophthalate 411.15 View
309 dimethyl phthalate 419 View
310 dioctyl phthalate 489 View
311 ethyl benzoate 357.15 View
312 methyl benzoate 355.15 View
313 n-propyl benzoate 371.15 View
314 nonylphenol 411 View
315 phenol 353 View
316 phenylmethanol 374 View
317 xylen-2,4-ol 368.15 View
318 xylen-2,6-ol 346.15 View
319 (1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexan-1-ol 366.15 View
320 1-methylcyclohexan-1-ol 338.15 View
321 1,2,3,6-tetrahydrobenzyl alcohol 346.15 View
322 1,4-cyclohexanedimethanol 434.15 View
323 2-(4-methylcyclohex-3-en-1-yl)propan-2-ol 367.15 View
324 4-methyl-cyclohexane-methanol 354 View
325 5-methyloxolan-2-one 354 View
326 cis-2-methylcyclohexanol 331.15 View
327 cis-3-methylcyclohexanol 335.15 View
328 cis-4-methylcyclohexanol 343.15 View
329 cyclohexanol 341 View
330 cyclohexyl ethanoate 330.15 View
331 cyclohexyl methanoate 324.15 View
332 dimethyl-1,4-cyclohexanedicarboxylate 383.15 View
333 oxepan-2-one 382.15 View
334 oxetan-2-one 343.15 View
335 oxolan-2-one 371.48 View
336 trans-2-methylcyclohexanol 331.15 View
337 trans-3-methylcyclohexanol 335.15 View
341 1-ethylpropyl ethanoate 318 View
342 1-methylethenyl ethanoate 283 View
343 1,2-dimethylpropyl ethanoate 316 View
345 2-ethylhexyl ethanoate 344.15 View
348 2-ethylhexyl prop-2-enoate 355.15 View
349 2,2-dimethylpropyl methanoate 311 View
350 2,2-dimethylpropyl propanoate 334 View
359 allyl 2-methylpropenoate 306.15 View
360 allyl ethanoate 295.37 View
361 allylidene diethanoate 355.37 View
366 butyl 2-methylprop-2-enoate 322 View
367 butyl butanoate 326.48 View
371 butyl ethanoate 295 View
373 butyl methanoate 291 View
376 butyl prop-2-enoate 312 View
377 butyl propanoate 305.37 View
384 decyl ethanoate 378 View
386 decyl methanoate 373 View
389 di(2-ethylhexyl)hexanedioate 466 View
390 diallyl (2Z)-but-2-enedioate 393 View
391 dibutyl (2Z)-but-2-enedioate 413 View
392 dibutyl decanedioate 451.15 View
393 diethyl (2Z)-but-2-enedioate 366.15 View
394 diethyl butanedioate 363 View
395 diethyl carbonate 298 View
397 diethyl oxalate 395 View
398 diethyl propanedioate 366.15 View
399 dihexyl hexanedioate 464 View
400 dimethyl (2Z)-but-2-enedioate 368.15 View
401 dimethyl propanedioate 363.15 View
402 dioctyl hexanedioate 451.75 View
404 dodecyl butanoate 433 View
406 dodecyl ethanoate 389 View
408 dodecyl propanoate 421 View
410 ethenyl 2,2-dimethylpropanoate 282.15 View
411 ethenyl ethanoate 265 View
412 ethenyl methanoate 256 View
413 ethenyl propanoate 274 View
414 ethyl (2E,4E)-hexa-2,4-dienoate 342.15 View
415 ethyl (2E,4Z)-deca-2,4-dienoate 386.15 View
416 ethyl (2E)-but-2-enoate 275.15 View
417 ethyl (2E)-dec-2-enoate 364.15 View
418 ethyl (2E)-hex-3-enoate 332.15 View
419 ethyl (2E)-oct-2-enoate 371.15 View
420 ethyl (2E)-oct-4-enoate 352.15 View
424 ethyl (9Z)-octadec-9-enoate 365 View
425 ethyl 2-hydroxypropanoate 319 View
426 ethyl 2-methylprop-2-enoate 293.15 View
428 ethyl buta-2,3-dienoate 320.15 View
429 ethyl butanoate 297.15 View
430 ethyl decanoate 375.15 View
431 ethyl dodecanoate 386.15 View
432 ethyl eicosanoate 444 View
433 ethyl ethanoate 269 View
434 ethyl hept-6-enoate 352.15 View
435 ethyl heptadecanoate 428 View
436 ethyl heptanoate 347.15 View
437 ethyl hexadecanoate 386.15 View
438 ethyl hexanoate 326.15 View
439 ethyl isobutanoate 287 View
440 ethyl isopentanoate 298.15 View
441 ethyl methanoate 253.15 View
442 ethyl nonanoate 367.15 View
443 ethyl octadecanoate 441 View
444 ethyl octanoate 354.15 View
445 ethyl pentanoate 307.15 View
446 ethyl prop-2-enoate 282.15 View
447 ethyl propanoate 285 View
448 ethyl tetradecanoate 386.15 View
450 ethyl undec-10-enoate 386.15 View
451 ethyl undecanoate 386.15 View
452 ethylene glycol diethanoate 361.15 View
453 ethylene glycol diprop-2-enoate 373.15 View
455 heptyl ethanoate 349 View
462 hexyl ethanoate 310.15 View
464 hexyl methanoate 330 View
467 isobutyl 2-methylpropanoate 311.15 View
468 isobutyl 2-methylpropenoate 314.15 View
469 isobutyl butanoate 330 View
472 isobutyl ethanoate 291 View
474 isobutyl methanoate 302 View
476 isobutyl prop-2-enoate 304.26 View
477 isobutyl propanoate 320 View
479 isopentyl butanoate 331 View
481 isopentyl dodecanoate 386.15 View
482 isopentyl ethanoate 298.15 View
483 isopentyl hexanoate 358 View
484 isopentyl isopentanoate 345 View
485 isopentyl methanoate 314 View
486 isopentyl propanoate 321 View
490 isopropyl ethanoate 275 View
493 methyl (11E)-octadec-11-enoate 335.15 View
494 methyl (11Z)-eicos-11-enoate 386.15 View
495 methyl (11Z)-octadec-11-enoate 335.15 View
496 methyl (13Z)-docos-13-enoate 306.15 View
498 methyl (2E)-non-2-enoate 364.15 View
499 methyl (2E)-oct-2-enoate 356.15 View
500 methyl (2E)-penta-2,4-dienoate 310.15 View
501 methyl (2Z)-penta-2,4-dienoate 310.15 View
502 methyl (3E)-hex-3-enoate 319.15 View
503 methyl (3E)-non-3-enoate 361.15 View
504 methyl (3E)-pent-3-enoate 297.15 View
505 methyl (3Z)-non-3-enoate 361.15 View
506 methyl (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate 366.15 View
507 methyl (5Z,8Z,11Z,14Z,17Z)-eicosa-5,8,11,14,17-pentaenoate 377.15 View
508 methyl (6E,9E,12E)-octadeca-6,9,12-trienoate 335.15 View
509 methyl (6E,9E,12Z)-octadeca-6,9,12-trienoate 335.15 View
510 methyl (6E,9Z,12E)-octadeca-6,9,12-trienoate 335.15 View
511 methyl (6E,9Z,12Z)-octadeca-6,9,12-trienoate 335.15 View
512 methyl (6Z,9E,12E)-octadeca-6,9,12-trienoate 335.15 View
513 methyl (6Z,9E,12Z)-octadeca-6,9,12-trienoate 335.15 View
514 methyl (6Z,9Z,12E)-octadeca-6,9,12-trienoate 335.15 View
515 methyl (6Z,9Z,12Z)-octadeca-6,9,12-trienoate 335.15 View
516 methyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate 386.15 View
517 methyl (9Z,12Z)-octadeca-9,12-dienoate 386.15 View
518 methyl (9Z)-hexadec-9-enoate 386.15 View
519 methyl (9Z)-octadec-9-enoate 386.15 View
520 methyl 10-undecenoate 373.15 View
521 methyl 2-methylprop-2-enoate 284.15 View
522 methyl 2-methylpropanoate 276.15 View
523 methyl but-3-enoate 293.15 View
524 methyl butanoate 287 View
525 methyl decanoate 367.15 View
526 methyl dodecanoate 386.15 View
527 methyl eicosanoate 386.15 View
528 methyl ethanoate 263.15 View
529 methyl heneicosanoate 386.15 View
530 methyl heptadecanoate 383.15 View
531 methyl heptanoate 325.15 View
532 methyl hex-5-enoate 319.15 View
533 methyl hexadecanoate 425 View
534 methyl hexanoate 316.15 View
535 methyl methanoate 254 View
536 methyl nonadecanoate 386.15 View
537 methyl nonanoate 360.15 View
538 methyl octadecanoate 388 View
539 methyl octanoate 342.15 View
540 methyl pent-4-enoate 302.15 View
541 methyl pentadecanoate 386.15 View
542 methyl prop-2-enoate 270 View
543 methyl propanoate 271 View
545 methyl tridecanoate 386.15 View
547 n-butyl octadecanoate 433.15 View
548 n-propyl ethanoate 288 View
549 n-propyl methanoate 270 View
550 n-propyl propanoate 292.15 View
551 neopentyl ethanoate 316 View
552 nonyl ethanoate 372.15 View
553 nonyl methanoate 360 View
557 octyl butanoate 378 View
559 octyl ethanoate 359.15 View
561 octyl methanoate 353 View
568 pentyl butanoate 345 View
572 pentyl ethanoate 312.15 View
574 pentyl methanoate 319 View
577 pentyl propanoate 336 View
585 propyl 2-methylprop-2-enoate 322 View
592 propyl prop-2-enoate 311 View
597 sec-butyl ethanoate 255.15 View
599 sec-butyl methanoate 299 View
601 tert-butyl 2-methylprop-2-enoate 300.15 View
602 tert-butyl butanoate 320 View
603 tert-butyl ethanoate 287.25 View
604 tert-butyl methanoate 264.15 View
606 tetradecyl methanoate 433 View
608 undecyl butanoate 421 View
609 undecyl ethanoate 398 View
610 undecyl methanoate 385 View
611 undecyl propanoate 410 View
618 1-methyl-4-(prop-1-en-2-yl)cyclohex-1-ene 318.15 View
619 1-methyl-4-(propan-2-yl)cyclohexa-1,3-diene 319.15 View
620 1-methyl-4-(propan-2-yl)cyclohexa-1,4-diene 324.15 View
621 1-trans-3,5-trimethylcyclohexane 292.15 View
622 1,1-diethylcyclohexane 322.15 View
623 1,1-dimethylcyclohexane 280 View
624 1,1-dimethylcyclopentane 257 View
628 1,3-dimethyladamantane 325.15 View
639 2-methyl-5-propan-2-ylcyclohexa-1,3-diene 322 View
641 2-norbornene 258.15 View
645 3-methylidene-6-(propan-2-yl)cyclohex-1-ene 322.15 View
646 3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptane 309.15 View
652 4,6,6-trimethylbicyclo[3.1.1]hept-3-ene 303.15 View
653 5-ethylidene-2-norbornene 311.15 View
656 6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptane 304 View
657 bicyclohexyl 347.15 View
658 butylcyclohexane 321 View
659 butylcyclopentane 308 View
661 cis-1,2-dimethylcyclohexane 284 View
662 cis-1,2-dimethylcyclopentane 269 View
663 cis-1,3-dimethylcyclohexane 279 View
664 cis-1,4-dimethylcyclohexane 279 View
665 cis-decalin 323.15 View
666 cyclodecane 338 View
667 cyclododeca-1,5,9-triene 360.15 View
668 cycloheptane 267.15 View
669 cyclohexa-1,3-diene 257 View
670 cyclohexa-1,4-diene 262.15 View
671 cyclohexane 253.15 View
672 cyclononane 316 View
673 cycloocta-1,3,5,7-tetraene 295 View
674 cycloocta-1,5-diene 308.15 View
675 cyclooctane 303.15 View
676 cyclopenta-1,3-diene 273 View
677 cyclopentane 236 View
679 dicyclopentadiene 305.37 View
682 ethenylnorbornene 300.15 View
683 ethylcyclohexane 295.15 View
684 ethylcyclopentane 269 View
689 isopropylcyclohexane 308.15 View
690 isopropylcyclopentane 287 View
691 methylcyclohexane 267.15 View
692 methylcyclopentadiene 322.04 View
693 methylcyclopentane 246 View
694 methylenecyclopentane 254 View
701 pentylcyclohexane 339 View
702 prop-2-enylcyclohexane 302 View
703 prop-2-enylcyclopentane 285 View
704 propylcyclohexane 304 View
705 propylcyclopentane 289 View
709 terpinolene 311 View
710 tert-butylcyclohexane 315 View
713 trans-1,2-dimethylcyclohexane 280 View
714 trans-1,3-dimethylcyclohexane 281 View
715 trans-1,4-dimethylcyclohexane 284.15 View
716 trans-decalin 325.15 View
725 (2E,4E)-hexa-2,4-diene 266.15 View
726 (2E)-2-hexene 246 View
727 (2E)-2-pentene 228 View
728 (2E)-3-heptene 267.15 View
729 (2E)-3-methylpent-2-ene 246 View
730 (2E)-4-methylpent-2-ene 239 View
731 (2E)-hept-2-ene 272 View
732 (2E)-oct-2-ene 294.26 View
733 (2Z,4E)-hexa-2,4-diene 266.15 View
734 (2Z)-3-methylpent-2-ene 245 View
735 (2Z)-4-methylpent-2-ene 237 View
736 (2Z)-but-2-ene 200 View
737 (2Z)-hept-2-ene 265 View
738 (2Z)-hex-2-ene 247 View
739 (2Z)-oct-2-ene 294 View
740 (2Z)-pent-2-ene 226 View
741 (3E)-1,3-hexadiene 254.15 View
742 (3E)-3-hexene 261.15 View
743 (3E)-3-octene 282 View
744 (3Z)-hept-3-ene 264 View
745 (3Z)-hex-3-ene 245 View
746 (3Z)-oct-3-ene 290 View
748 (4E)-hexa-1,4-diene 248.15 View
749 (4E)-oct-4-ene 281 View
752 (4Z)-hexa-1,4-diene 248.15 View
753 (4Z)-oct-4-ene 290 View
767 1-methylcyclohex-1-ene 272 View
768 1-methylcyclopent-1-ene 256 View
769 1,3-dimethylcyclohex-1-ene 285 View
770 2-ethylbut-1-ene 247.15 View
771 2-ethylpent-1-ene 263 View
772 2-methylbut-1-ene 226 View
773 2-methylbut-2-ene 228 View
774 2-methylhept-1-ene 283 View
775 2-methylhept-2-ene 281 View
776 2-methylhex-1-ene 267 View
777 2-methylpent-1-ene 247 View
778 2-methylpent-2-ene 250 View
779 2-methylprop-1-ene 197 View
781 2,3-dimethylbut-1-ene 255.15 View
782 2,3-dimethylbut-2-ene 257.15 View
783 2,3-dimethylbuta-1,3-diene 251.15 View
784 2,3-dimethylhex-1-ene 281 View
785 2,3-dimethylpent-1-ene 256 View
786 2,3,3-trimethylbut-1-ene 256.15 View
787 2,3,4-trimethylpent-2-ene 275 View
788 2,4,4-trimethylpent-1-ene 268 View
789 2,4,4-trimethylpent-2-ene 272.15 View
790 2,5-dimethylhexa-1,5-diene 280 View
791 2,5-dimethylhexa-2,4-diene 297.15 View
793 3-ethylhex-1-ene 274 View
794 3-ethylpent-1-ene 256 View
795 3-ethylpent-2-ene 267 View
796 3-methylbut-1-ene 217 View
797 3-methylbuta-1,2-diene 261.15 View
798 3-methylcyclohex-1-ene 270 View
799 3-methylhex-1-ene 255 View
800 3-methylpent-1-ene 245 View
801 3-methylpenta-1,3-diene 245 View
803 3,3-dimethylbut-1-ene 245.15 View
804 4-ethenylcyclohex-1-ene 289 View
806 4-methylhept-1-ene 275 View
807 4-methylhex-1-ene 258 View
808 4-methylpent-1-ene 242 View
809 4-methylpenta-1,3-diene 255 View
810 4,4-dimethylpent-1-ene 261 View
811 5-methylhex-1-ene 263 View
813 7-methyloct-1-ene 291 View
816 but-1-ene 193 View
817 buta-1,3-diene 197.15 View
818 cycloheptene 267.15 View
819 cyclohexene 243.15 View
820 cyclooctene 298.15 View
821 cyclopentene 244 View
822 dec-1-ene 311 View
824 dodec-1-ene 346 View
826 hept-1-ene 265.15 View
828 hepta-1,6-diene 263 View
829 heptadec-1-ene 408 View
830 hex-1-ene 247 View
831 hexa-1,5-diene 246 View
832 hexadec-1-ene 405.15 View
833 isoprene 219.26 View
834 non-1-ene 298 View
835 nona-1,8-diene 299 View
836 oct-1-ene 281 View
837 octa-1,7-diene 282 View
838 octadec-1-ene 421.15 View
839 pent-1-ene 222 View
840 pentadec-1-ene 385 View
841 propylene 165 View
842 tetradec-1-ene 370 View
843 tridec-1-ene 352.15 View
844 undec-1-ene 327 View
918 2-methylheptane 277.15 View
920 2-methylhexane 255 View
922 2-methylnonane 314 View
924 2-methyloctane 297 View
929 2,2-dimethylbutane 225 View
931 2,2-dimethylheptane 297 View
932 2,2-dimethylhexane 269 View
933 2,2-dimethyloctane 304 View
934 2,2-dimethylpentane 258.15 View
935 2,2-dimethylpropane 208 View
936 2,2,3-trimethylbutane 249 View
937 2,2,3-trimethylhexane 288 View
938 2,2,3-trimethylpentane 270 View
939 2,2,3,3-tetramethylbutane 278 View
940 2,2,3,3-tetramethylhexane 304 View
941 2,2,3,3-tetramethylpentane 289 View
942 2,2,3,4-tetramethylhexane 304 View
943 2,2,3,4-tetramethylpentane 284 View
944 2,2,4-trimethylhexane 288 View
945 2,2,4-trimethylpentane 261 View
946 2,2,4,4-tetramethylhexane 304 View
947 2,2,4,4-tetramethylpentane 276 View
948 2,2,4,4,6,8,8-heptamethylnonane 368.15 View
952 2,2,5-trimethylhexane 286 View
953 2,2,5,5-tetramethylhexane 289 View
954 2,3-dimethylbutane 244 View
956 2,3-dimethylheptane 288 View
957 2,3-dimethylhexane 278.48 View
958 2,3-dimethyloctane 309 View
959 2,3-dimethylpentane 258 View
960 2,3,3-trimethylhexane 288 View
961 2,3,3-trimethylpentane 273 View
962 2,3,3,4-tetramethylhexane 304 View
963 2,3,3,4-tetramethylpentane 284 View
964 2,3,4-trimethylhexane 288 View
965 2,3,4-trimethylpentane 273 View
966 2,3,4,4-tetramethylhexane 304 View
967 2,3,4,5-tetramethylhexane 304 View
968 2,3,5-trimethylheptane 304 View
969 2,3,5-trimethylhexane 288 View
976 2,4-dimethylheptane 288 View
977 2,4-dimethylhexane 283.15 View
978 2,4-dimethylpentane 261 View
979 2,4,4-trimethylhexane 288 View
980 2,4,5-trimethylheptane 304 View
981 2,4,6-trimethylheptane 304 View
983 2,5-dimethylheptane 288 View
984 2,5-dimethylhexane 271 View
988 2,6-dimethylheptane 299 View
989 2,6-dimethyloctane 307 View
990 2,6,10,15,19,23-hexamethyltetracosane 490 View
995 2,7-dimethyloctane 314 View
999 3-ethyl-2-methylpentane 276 View
1000 3-ethyl-2,2-dimethylhexane 311 View
1001 3-ethyl-2,2-dimethylpentane 286 View
1002 3-ethyl-2,3-dimethylpentane 288 View
1003 3-ethyl-2,3,4-trimethylpentane 304 View
1004 3-ethyl-2,4-dimethylpentane 288 View
1005 3-ethyl-3-methylheptane 314 View
1006 3-ethyl-3-methylpentane 276 View
1007 3-ethyl-4-methylhexane 288 View
1008 3-ethyl-5-methylheptane 304 View
1015 3-ethylhexane 278 View
1021 3-ethylpentane 261 View
1030 3-methylheptane 279 View
1032 3-methylhexane 269 View
1033 3-methylnonane 311 View
1035 3-methyloctane 297 View
1036 3-methylpentane 241 View
1037 3,3-diethylpentane 294 View
1038 3,3-dimethylhexane 272 View
1039 3,3-dimethyloctane 314 View
1040 3,3-dimethylpentane 254 View
1041 3,3,4-trimethylhexane 288 View
1042 3,3,4,4-tetramethylhexane 304 View
1043 3,3,5-trimethylheptane 304 View
1044 3,4-dimethylheptane 288 View
1045 3,4-dimethylhexane 277 View
1046 3,4,5-trimethylheptane 304 View
1047 3,5-dimethylheptane 288 View
1048 3,5-dimethyloctane 314 View
1063 4-ethyl-3-methylheptane 314 View
1065 4-ethylheptane 288 View
1067 4-ethyloctane 314 View
1071 4-methylheptane 279.15 View
1072 4-methylnonane 311 View
1073 4-methyloctane 295 View
1079 4-propylheptane 314 View
1089 4,4-dimethylheptane 288 View
1102 5-methylnonane 312 View
1138 isobutane 190.15 View
1139 isohexane 250 View
1140 isopentane 217.15 View
1143 n-decane 319 View
1144 n-dodecane 347 View
1146 n-heptadecane 421.15 View
1147 n-heptane 269 View
1148 n-hexadecane 408.15 View
1149 n-hexane 251.5 View
1150 n-nonadecane 441 View
1151 n-nonane 304 View
1152 n-octadecane 438.15 View
1153 n-octane 286 View
1154 n-pentadecane 388 View
1155 n-pentane 233.15 View
1157 n-tetradecane 373.15 View
1158 n-tridecane 352 View
1159 n-undecane 338.15 View

Bibliography

  1. Saldana, D. A.; Starck, L.; Mougin, P.; Rousseau, B.; Pidol, L.; Jeuland, N.; Creton, B. Flash Point and Cetane Number Predictions for Fuel Compounds Using Quantitative Structure Property Relationship (QSPR) Methods. Energy & Fuels 2011, 25, 3900–3908. http://dx.doi.org/10.1021/ef200795j