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THIAZOPYR

CAS No.:
117718-60-2
Catalog Number:
AG008RKM
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG008RKM
Chemical Name:
THIAZOPYR
CAS Number:
117718-60-2
MDL Number:
MFCD00870491
IUPAC Name:
methyl 2-(difluoromethyl)-5-(4,5-dihydro-1,3-thiazol-2-yl)-4-(2-methylpropyl)-6-(trifluoromethyl)pyridine-3-carboxylate
InChI:
InChI=1S/C16H17F5N2O2S/c1-7(2)6-8-9(15(24)25-3)11(13(17)18)23-12(16(19,20)21)10(8)14-22-4-5-26-14/h7,13H,4-6H2,1-3H3
InChI Key:
YIJZJEYQBAAWRJ-UHFFFAOYSA-N
EC Number:
601-493-0
UNII:
AEQ9R142XI
Properties
Complexity:
541  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
396.093g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
396.376g/mol
Monoisotopic Mass:
396.093g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
76.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Literature
Title Journal
Environmental impact on vascular development predicted by high-throughput screening. Environmental health perspectives 20111101
Effect of endocrine disruptor pesticides: a review. International journal of environmental research and public health 20110601
Impact of environmental chemicals on key transcription regulators and correlation to toxicity end points within EPA's ToxCast program. Chemical research in toxicology 20100315
Thiazopyr and thyroid disruption: case study within the context of the 2006 IPCS Human Relevance Framework for analysis of a cancer mode of action. Critical reviews in toxicology 20060101
Adsorption and degradation of thiazopyr in compost-amended and non-amended soils. Pest management science 20010601
Properties