Tulp, I.; Tamm, T.; Karelson, G.; Dobchev, D.; Martin, D.; Tämm, K.; Savchenko, D.; Jänes, J.; Härk, E.; Kreegipuu, A.; Karelson, M. QSAR for abiotic degradation in air. Q13-22a-0034. Molcode Ltd., 2010.

250 compounds | Property logT(0.5): Degradation half-life in air [log(h)]

ID	Name	logT(0.5)	Details
1	phenol	1.23	View
2	3-methylpyridine	2.74	View
3	cyclohexanol	1.74	View
4	cyclohexanone	1.74	View
5	1-pentene	0.699	View
6	n-butyl amine	1.23	View
7	furan	1.23	View
8	thiophene	1.74	View
9	2-chloroethyl vinyl ether	1.23	View
10	cyclohexane	1.23	View
11	2-heptanone	1.74	View
12	butanoic acid	1.74	View
13	2-pentanone	1.74	View
14	chloromethyl methyl ether	1.23	View
15	m-Xylene	1.23	View
16	4-methyl-2-pentanone	1.74	View
17	vinyl acetate	1.74	View
18	bromobenzene	2.23	View
19	1,3,5-trimethylbenzene	1.23	View
20	cyclohexylamine	0.699	View
21	4-methylpyridine	2.74	View
22	methylbenzene	1.23	View
23	anisole	1.23	View
24	diphenyl ether	1.23	View
25	n-propylbenzene	1.23	View
26	2,4-dimethylphenol	1.23	View
27	1,4-dichlorobenzene	2.74	View
28	4-chloroaniline	0.699	View
29	1,3-butadiene	0.699	View
30	acrolein	0.699	View
31	1,2-dichloroethane	3.23	View
32	acrylonitrile	1.74	View
33	ethylene glycol	1.74	View
34	1,2,4-trimethylbenzene	1.23	View
35	1,2,3-trichloropropane	2.74	View
36	styrene oxide	1.23	View
37	iso-propylbenzene	1.23	View
38	4-nitrophenol	1.74	View
39	4-nitrotoluene	1.23	View
40	styrene	0.699	View
41	quinoline	1.74	View
42	2-naphthalamine	0.699	View
43	1-methylnaphthalene	1.23	View
44	phthalic acid	1.74	View
45	2-methoxyphenol	1.23	View
46	2-nitrophenol	1.74	View
47	o-Cresol	0.699	View
48	1,2-dichlorobenzene	2.74	View
49	o-Xylene	1.23	View
50	2,4-D	1.23	View
51	benzidine	0.699	View
52	1,1,2,2-tetrachloroethane	4.23	View
53	methyl acetate	1.74	View
54	chloroacetic acid	2.74	View
55	trichloroethylene	2.23	View
56	1,2-dichloropropane	2.74	View
57	2,4,6-trichlorophenol	2.23	View
58	2,6-dimethylbenzamine	0.699	View
59	fluorene	1.74	View
60	butylbenzyl phthalate	1.74	View
61	phenanthrene	1.74	View
62	dibutyl phthalate	1.74	View
63	diethyl phthalate	2.23	View
64	methoxychlor	1.23	View
65	p,p'-DDE	2.23	View
66	bromochloromethane	2.74	View
67	propanol	1.74	View
68	1-butanol	1.74	View
69	1-pentanol	1.74	View
70	tert-butyl alcohol	2.23	View
71	dalapon	2.74	View
72	2-Methyl-1-propanol	1.74	View
73	ethylamine	1.23	View
74	ethanal	0.699	View
75	dichloromethane	3.23	View
76	methanamine, N-methyl-N-nitroso-	0.699	View
77	formic acid	2.23	View
78	ethanol	1.74	View
79	acetamide	1.23	View
80	thioacetamide	1.23	View
81	aniline	0.699	View
82	chloroform	3.23	View
83	salicylic acid	1.74	View
84	hexachloroethane	4.23	View
85	benzoic acid	1.74	View
86	isopropanol	1.74	View
87	methanol	2.23	View
88	benzamide	1.23	View
89	2-Chlorodibenzo-4-dioxin	2.23	View
90	2,2',3,3',4,5,5',6,6'-nonachlorobiphenyl i	4.23	View
91	parathion	1.23	View
92	octachlorodibenzofuran	2.74	View
93	1,2,3,4,7-pentachlorodibenzo-p-dioxin	2.74	View
94	benz[a]anthracene	2.23	View
95	1,2,4-trichlorodibenzo-p-dioxin	2.23	View
96	ethyl ether	1.23	View
97	metolachlor	2.23	View
98	gamma-hexachlorocyclohexane	2.23	View
99	2,3,7,8-TCDF	2.23	View
100	3,3',4,4',5,5'-hexachlorobiphenyl i	3.74	View
101	2,2',3,3',4,5,6-heptachlorobiphenyl	3.74	View
102	2,3,3',4',5'-pentachlorobiphenyl i	3.23	View
103	2,7-dichlorodibenzo-p-dioxin	2.23	View
104	benzo[a]pyrene	2.23	View
105	1,2,3,4-tetrachlorodibenzo-p-dioxin	2.23	View
106	p,p'-DDT	2.23	View
107	octachlorodibenzo-p-dioxin	2.74	View
108	4-chlorophenyl phenyl ether	1.23	View
109	2,8-dichlorodibenzofuran	2.23	View
110	toxaphene i	2.23	View
111	mecoprop	1.23	View
112	atrazine	0.699	View
113	2,3,7,8-TCDD	2.23	View
114	decachlorobiphenyl	4.74	View
115	dicamba	1.74	View
116	diallate	1.23	View
117	3-chlorobiphenyl	2.23	View
118	1,2,3,4-tetrachlorobenzene	3.23	View
119	1,2,3,5-tetrachlorobenzene	3.23	View
120	1-hexyne	0.699	View
121	EPTC	1.23	View
122	1-ethylnaphthalene	1.23	View
123	trifluralin	2.23	View
124	methyl t-butyl ether	1.23	View
125	allyl acetate	1.74	View
126	vinylacetic acid	1.23	View
127	1,4-cyclohexadiene	0.699	View
128	pentyl acetate	1.74	View
129	2-hexanone	1.74	View
130	1,3-dichlorobenzene	2.74	View
131	1,2,3-trimethylbenzene	1.23	View
132	indane	1.23	View
133	fluorobenzene	1.23	View
134	linuron	1.23	View
135	diuron	1.23	View
136	delta-hexachlorocyclohexane	2.23	View
137	parathion methyl	1.23	View
138	chrysene	2.23	View
139	cyclopentane	1.23	View
140	benzo[k]fluoranthene	2.23	View
141	ethyl acetate	1.74	View
142	thiram	2.23	View
143	1-naphthylamine	0.699	View
144	pyrene	2.23	View
145	dimethyl phthalate	2.23	View
146	dimethylamine	0.699	View
147	chloroprene	1.74	View
148	butyl acetate	1.74	View
149	butanal	0.699	View
150	propanal	0.699	View
151	diphenylamine	0.699	View
152	2,4-dichlorophenol	1.74	View
153	n,n-dimethylaniline	0.699	View
154	benzophenone	2.74	View
155	2-chlorobenzoic acid	2.23	View
156	catechol	1.23	View
157	anthracene	1.74	View
158	aldicarb	0.699	View
159	hexachlorobenzene	4.23	View
160	1-octanol	1.74	View
161	bis(2-chloroethoxy)methane	1.23	View
162	di-n-propyl ether	1.23	View
163	bis(2-chloroethyl)ether	1.23	View
164	octane	1.23	View
165	cyclohexene	0.699	View
166	1-hexanol	1.74	View
167	diethanolamine	0.699	View
168	propyl acetate	1.74	View
169	pentane	1.23	View
170	ethyl formate	1.74	View
171	tetrahydrofuran	1.23	View
172	hexane	1.23	View
173	dibenz[a,h]anthracene	2.23	View
174	methyl formate	1.74	View
175	2,8-dichlorodibenzo-p-dioxin	2.23	View
176	carbon tetrachloride	4.23	View
177	chlordane	1.74	View
178	bis-(2-chloroisopropyl) ether	1.23	View
179	methylcyclohexane	1.23	View
180	1,3,5-trichlorobenzene	2.74	View
181	2,2'-dichlorobiphenyl i	2.23	View
182	chlorobenzene	2.23	View
183	1,2,3,4,6,7,8-heptachlorodibenzo-p-dioxin	2.74	View
184	isopropalin	1.23	View
185	benzyl alcohol	1.74	View
186	o,p'-DDE	2.23	View
187	phenylacetic acid	1.74	View
188	p-Xylene	1.23	View
189	2,3,4-trichlorobiphenyl	2.74	View
190	benomyl	0.699	View
191	propionitrile	3.23	View
192	allyl alcohol	1.74	View
193	tetrachloroguaiacol	2.23	View
194	triallate	2.23	View
195	2-methylbenzenamine	0.699	View
196	2-chloroaniline	1.74	View
197	1,2,4,5-tetramethylbenzene	1.23	View
198	2,4,5-trichlorophenol	2.23	View
199	1,2,4,5-tetrachlorobenzene	3.23	View
200	carbofuran	0.699	View
201	3-pentanone	1.74	View
202	1,4-pentadiene	0.699	View
203	nitrobenzene	0.699	View
204	butyl formate	1.74	View
205	acetophenone	2.74	View
206	pentachlorobenzene	3.74	View
207	N-Nitrosodipropylamine	0.699	View
208	ethylbenzene	1.23	View
209	iodobenzene	2.23	View
210	2,3-dimethylnaphthalene	1.23	View
211	naphthalene	1.23	View
212	Bis(chloromethyl)ether	1.23	View
213	4,6-dinitro-o-cresol	2.23	View
214	2-nitrotoluene	1.23	View
215	diazinon	2.74	View
216	benzo[b]thiophene	2.23	View
217	2,4-DB	1.74	View
218	aldrin	0.699	View
219	1,1'-biphenyl	1.74	View
220	cyclooctane	1.23	View
221	methyl methacrylate	1.23	View
222	fluoranthene	2.23	View
223	acrylic acid	1.23	View
224	hexanoic acid	1.74	View
225	perylene	2.23	View
226	2-butanone	2.23	View
227	cyclopentene	0.699	View
228	ethanolamine	0.699	View
229	dibenzofuran	1.74	View
230	diphenylnitrosoamine	0.699	View
231	decane	1.23	View
232	vinyl chloride	1.74	View
233	1,4-dioxane	1.23	View
234	simazine	1.74	View
235	malathion	1.23	View
236	benzene	1.23	View
237	1,2,4-trichlorobenzene	2.74	View
238	pentachloroethane	4.23	View
239	2,4-dinitrotoluene	1.23	View
240	bromodichloromethane	2.74	View
241	1-naphthalenol, methylcarbamate	1.74	View
242	dimethyl ether	1.23	View
243	2-methylbenzoic acid	1.74	View
244	dieldrin	1.74	View
245	dodecane	1.23	View
246	propoxur	0.699	View
247	acetone	3.23	View
248	1-octene	0.699	View
249	acetic acid	1.74	View
250	pyridine	2.74	View

Bibliography

Mackay, D.; Shiu, W. Y.; Ma, K.-C. Chapman and Hall/CRC: 2000.

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10967/223 - QDB Compounds

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Tulp, I.; Tamm, T.; Karelson, G.; Dobchev, D.; Martin, D.; Tämm, K.; Savchenko, D.; Jänes, J.; Härk, E.; Kreegipuu, A.; Karelson, M. QSAR for abiotic degradation in air. Q13-22a-0034. Molcode Ltd., 2010.

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