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119209-27-7 | 3-Butenoic acid, 2-[[[(3,5-dichlorophenyl)amino]carbonyl]oxy]-2-methyl-
CAS No: 119209-27-7 Catalog No: AG000IE3 MDL No:
Product Description
Catalog Number:
AG000IE3
Chemical Name:
3-Butenoic acid, 2-[[[(3,5-dichlorophenyl)amino]carbonyl]oxy]-2-methyl-
CAS Number:
119209-27-7
Molecular Formula:
C12H11Cl2NO4
Molecular Weight:
304.1260
IUPAC Name:
2-[(3,5-dichlorophenyl)carbamoyloxy]-2-methylbut-3-enoic acid
InChI:
InChI=1S/C12H11Cl2NO4/c1-3-12(2,10(16)17)19-11(18)15-9-5-7(13)4-8(14)6-9/h3-6H,1H2,2H3,(H,15,18)(H,16,17)
InChI Key:
KTXGWKXVQGCPAR-UHFFFAOYSA-N
SMILES:
C=CC(C(=O)O)(OC(=O)Nc1cc(Cl)cc(c1)Cl)C
Properties
Complexity:
367
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.007g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
304.123g/mol
Monoisotopic Mass:
303.007g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Literature
| Title | Journal |
|---|---|
| In vitro metabolism of the anti-androgenic fungicide vinclozolin by rat liver microsomes. | Archives of toxicology 20120301 |
| Effect of endocrine disruptor pesticides: a review. | International journal of environmental research and public health 20110601 |
| Early-onset endocrine disruptor-induced prostatitis in the rat. | Environmental health perspectives 20080701 |
| Steroid receptor profiling of vinclozolin and its primary metabolites. | Toxicology and applied pharmacology 20061001 |
| Mode of action: inhibition of androgen receptor function--vinclozolin-induced malformations in reproductive development. | Critical reviews in toxicology 20050101 |
| Liquid chromatography determination of the anti-androgen vinclozolin and its metabolites in rat serum. | Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20040925 |
| A novel cell line, MDA-kb2, that stably expresses an androgen- and glucocorticoid-responsive reporter for the detection of hormone receptor agonists and antagonists. | Toxicological sciences : an official journal of the Society of Toxicology 20020301 |
| Environmental xenoestrogens, antiandrogens and disorders of male sexual differentiation. | Molecular and cellular endocrinology 20010610 |
| Peripubertal exposure to the antiandrogenic fungicide, vinclozolin, delays puberty, inhibits the development of androgen-dependent tissues, and alters androgen receptor function in the male rat. | Toxicology and industrial health 19990101 |
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