10967/38 - QDB Compounds

QsarDB Repository

Akers, K.S.; Sinks, G.D.; Schultz, T.W. Structure-toxicity relationships for selected halogenated aliphatic chemicals. Environ. Toxicol. Pharmacol. 1999, 7, 1, 33–39.

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

IDNamepIGC50Details
12-chloroethanol-1.42View
22,2-dichloroethanol-0.99View
32,2,2-trichloroethanol-0.46View
41-chloro-2-propanol-1.49View
51,3-dichloro-2-propanol-0.79View
63-chloro-2,2-dimethyl-1-propanol-0.78View
73-chloro-1,2-propanediol-1.63View
83-chloro-1-propanol-1.40View
94-chloro-1-butanol-0.76View
106-chloro-1-hexanol-0.27View
118-chloro-1-octanol0.49View
122-bromoethanol-0.85View
132,2,2-tribromoethanol0.11View
141-bromo-2-propanol-1.19View
151,3-dibromo-2-propanol0.57View
163-bromo-2,2-dimethyl-1-propanol-0.46View
173-bromo-1,2-propanediol-1.21View
183-bromo-1-propanol-0.93View
196-bromo-1-hexanol0.01View
208-bromo-1-octanol1.04View
21Chloroacetonitrile0.85View
22Dichloroacetonitrile0.97View
23Trichloroacetonitrile1.88View
242-chloropropionitrile-0.86View
253-chloropropionitrile-1.12View
264-chlorobutyronitrile-0.93View
275-chlorovaleronitrile-0.63View
287-chloroheptanonitrile0.29View
29Bromoacetonitrile2.23View
30Dibromoacetonitrile2.40View
312-bromopropionitrile0.63View
323-bromopropionitrile-0.50View
334-bromobutyronitrile-0.88View
345-bromovaleronitrile-0.21View
357-bromoheptanonitrile0.51View
361-bromopentane0.48View
371-bromohexane0.94View
381-bromoheptane1.49View
391-bromooctane1.87View

Bibliography

  1. Akers, K. S.; Sinks, G. D.; Schultz, T. W. Structure-toxicity relationships for selected halogenated aliphatic chemicals. Environ. Toxicol. Pharmacol. 1999, 7, 33–39. http://dx.doi.org/10.1016/S1382-6689(98)00048-9

  2. Schultz, T. W. TETRATOX: Tetrahymena pyriformis population growth impairment endpoint - a surrogate for fish lethality. Toxicol. Mech. Meth. 1997, 7, 289–309. http://dx.doi.org/10.1080/105172397243079