10967/74 - QDB Compounds

QsarDB Repository

Sinks, G.D.; Carver, T.A.; Schultz, T.W. Structure-Toxicity Relationships for Aminoalkanols: A Comparison with Alkanols and Alkanamines. SAR QSAR Environ. Res. 1998, 9, 3-4, 217–228.

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

IDNamepIGC50RefDetails
1Isopropylamine-0.88View
2(tert)Butylamine-0.90View
3Propylamine-0.71[1]View
4(+/-)secButylamine-0.67[1]View
5Butylamine-0.57[1]View
6(tert)Amylamine-0.70View
71-Ethyl-propylamine-0.81View
81-Methyl-butylamine-0.69View
9Isoamylamine-0.58View
10Amylamine-0.48[1]View
112-Methylbutylamine-0.48View
123-Phenyl-1-propylamine0.28View
13Hexylamine-0.22[1]View
144-Phenyl-1-butylamine0.62View
15Heptylamine0.21[1]View
16Octylamine0.61[1]View
17Nonylamine1.70View
18Decylamine2.06[1]View
19Undecylamine2.33[1]View
20DodecylamineNTASView
21TridecylamineNTASView
221,1-Dimethylpropargylamine-0.91View
23n-Methylpropylamine-0.81View
24n-Methylbutylamine-0.68View
25n-Methylpropargylamine-0.98View
26n,n-Dimethylethylamine-0.91View
27Ethanolamine-1.01View
281-Amino-2-propanol-0.84View
292-Amino-1-propanol-0.82View
303-Amino-1-propanol-0.81View
312-Amino-1-butanol-0.72View
324-Amino-1-butanol-0.98View
332-Amino-2-methyl-1-propanol-0.96View
342-Amino-1-pentanol-0.67View
355-Amino-1-pentanol-0.99View
363-Amino-2,2-dimethyl-1-propanol-0.92View
372-Amino-1-hexanol-0.59View
386-Amino-1-hexanol-0.96View
392-Amino-3-methyl-1-pentanol-0.66View
402-Amino-4-methyl-1-pentanol-0.62View
412-Amino-3,3-dimethyl-1-butanol-0.72View
422-(Methylamino)ethanol-0.76View
432-(Ethylamino)ethanol-0.76View
442-(Propylamino)ethanol-0.77View
452-(tert-Butylamino)ethanol-0.80View
463-Methoxypropylamine-0.77View
473-Ethoxypropylamine-0.76View
48Diethanolamine-1.03View
49n-Methyldiethanolamine-1.06View

Bibliography

  1. Schultz, T. W.; Wilke, T. S.; Bryant, S. E.; Hosein, L. M. QSARs for selected aliphatic and aromatic amines. Sci. Total Environ. 1991, 109, 581–587. http://dx.doi.org/10.1016/0048-9697(91)90211-V

  2. Sinks, G. D.; Carver, T. A.; Schultz, T. W. Structure-Toxicity Relationships for Aminoalkanols: A Comparison with Alkanols and Alkanamines. SAR QSAR Environ. Res. 1998, 9, 217–228. http://dx.doi.org/10.1080/10629369808039157

  3. Schultz, T. W. Tetrahymena in aquatic toxicology: QSARs and ecological hazard assessment. In Proceedings of the International Workshop on a Protozoan Test Protocol with Tetrahymena in Aquatic Toxicity Testing; Pauli, W.; Berger, S., Eds.; German Federal Environmental Agency; 1996.