10967/63 - QDB Compounds

QsarDB Repository

Schultz, T.W.; Yarbrough, J.W. Trends in structure-toxicity relationships for carbonyl-containing α,β-unsaturated compounds. SAR QSAR Environ. Res. 2004, 15, 2, 139–146.

30 compounds | Property IGC50: 40-h Tetrahymena toxicity as IGC50 [mmol/L]

IDNameIGC50Details
13-Butyn-2-one0.011View
23-Buten-2-one0.031View
3Ethyl propiolate0.02View
4Ethyl acrylate0.305View
5Ethyl tetrolate0.31View
6Ethyl crotonate5.82View
7Methyl-2-octynoate0.091View
8Methyl-2-octenoate0.172View
9Methyl crotonate8.29View
10Propyl acrylate0.295View
111-Penten-3-one0.03View
123-Penten-2-one0.29View
131-Octen-3-one0.012View
143-Octen-2-one0.182View
153-Methyl-3-penten-2-one2.21View
164-Methyl-3-penten-2-one4.4View
17Methyl tiglate6.14View
182-Pentenal0.219View
192-Octenal0.063View
20Propargyl acrylate0.088View
21Allyl acrylate0.208View
22Vinyl crotonate1.4View
23Vinyl methacrylate4.16View
24Ethyl methacrylate8.6View
25n-Butyl acrylate0.303View
26(Tert)butyl acrylate4.37View
27n-Pentyl acrylate0.291View
28Isopentyl acrylate0.391View
29n-Propyl methacrylate4.52View
30Isopropyl methacrylate7.59View

Bibliography

  1. Schultz, T. W.; Yarbrough, J. W. Trends in structure-toxicity relationships for carbonyl-containing α,β-unsaturated compounds. SAR QSAR Environ. Res. 2004, 15, 139–146. https://doi.org/10.1080/10629360410001665839

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