10967/78 - QDB Compounds

QsarDB Repository

Bajot, F.; Cronin, M.T.D.; Roberts, D.W.; Schultz, T.W. Reactivity and aquatic toxicity of aromatic compounds transformable to quinone-type Michael acceptors. SAR QSAR Environ. Res. 2011, 1, 2, 51–65.

71 compounds | Property pIGC50: 40-h Tetrahymena toxicity as log(1/IGC50) [log(L/mmol)]

IDNamepIGC50Details
11,2,4-Triaminobenzene di-HClView
21,3,5-Trihydroxybenzene 2-H2O-1.26View
31,3-Dihydroxybenzene-0.64View
41,3-Phenylenediamine-0.58View
51,5-Dihydroxynaphthalene1.19View
61-NaphtholView
72,3-Dihydroxybenzaldehyde1.03View
82,4,6-Trihydroxybenzaldehyde0.09View
92,4-Dihydroxyacetophenone0.25View
102,4-Dihydroxypyridine-1.46View
112',5'-Dihydroxyacetophenone0.36View
122,7-Dihydroxynaphthalene0.55View
132-Amino-4-chloro-5-nitrophenol1.18View
142-Amino-4-chlorophenol0.77View
152-Amino-4-nitrophenol0.47View
162-Methylresorcinol0.03View
172-Nitro-1,4-phenylenediamine0.19View
182-n-Propylresorcinol0.22View
193,4-Dihydroxybenzonitrile1.26View
203-Amino-2-methylphenol-0.55View
213-Amino-4-chlorophenol0.10View
223-Amino-6-methylphenol-0.39View
233-Aminophenol-0.52View
244-Ethylresorcinol0.57View
254-Hexylresorcinol1.80View
264-Nitrocatechole1.17View
275-Pentylresorcinol1.31View
28Aniline-0.23View
29Methyl-2,4-dihydroxybenzoate0.61View
30Methyl-3,5-dihydroxybenzoate-0.14View
31Phenol-0.35View
324-Amino-2,6-dibromophenol1.55View
334-Amino-2,6-dichlorophenol1.29View
344-Amino-2-chlorophenol0.72View
354-Amino-2-methylphenol1.21View
364-Amino-2-nitrophenol0.93View
374-Amino-3-methylphenol0.96View
384-Aminophenol-0.08View
391,4-Dihydroxybenzene0.27View
402,3-Dimethylhydroquinone1.41View
412,5-Dibromohydroquinone1.55View
422,5-Dichlorohydroquinone1.52View
432,5-Dihydroxybenzaldehyde0.70View
442,6-Dimethoxyhydroquinone1.72View
45Bromohydroquinone1.68View
46Chlorohydroquinone0.93View
47Methyl-2,5-dihydroxybenzoate0.51View
48Methylhydroquinone1.68View
49Trimethylhydroquinone1.34View
501,4-Phenylenediamine0.16View
511,2-Phenylenediamine0.34View
522-Amino-4-methylphenol0.29View
532-Amino-4,6-dichloro-5-methylphenol1.66View
542-Aminophenol0.95View
552-Chloro-3',4'-dihydroxyacetophenone1.47View
561,2,Dihydroquinone0.52View
572,3-Dihydroxypyridine-0.34View
582,3-Dihydroxynaphthalene1.00View
593,4-Dihydroxybenzaldehyde0.49View
603,5-Dichlorocatechol1.37View
613-Fluorocatechol0.92View
623-Methylcatechol0.40View
634,5-Dichlorocatechol1.32View
644-Chlorocatechol1.10View
654-Methylcatechol0.49View
666,7-DihydroxycoumarinView
67Ethyl-3,4-dihydroxybenzoate0.77View
682,3,4-Trihydroxybenzaldehyde0.62View
694,6-Dinitropyrogallol0.18View
70Anthrarobin1.34View
71Pyrogallol0.85View

Bibliography

  1. Bajot, F.; Cronin, M. T. D.; Roberts, D. W.; Schultz, T. W. Reactivity and aquatic toxicity of aromatic compounds transformable to quinone-type Michael acceptors. SAR QSAR Environ. Res. 2011, 1, 51–65. http://dx.doi.org/10.1080/1062936X.2010.528449

  2. Aptula, A. O.; Roberts, D. W.; Cronin, M. T. D.; Schultz, T. W. Chemistry-Toxicity Relationships for the Effects of Di- and Trihydroxybenzenes to Tetrahymena pyriformis. Chem. Res. Toxicol. 2005, 18, 844–854. http://dx.doi.org/10.1021/tx049666n