Penthiopyrad
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Penthiopyrad
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CAS No:
183675-82-3
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Formula:
C16H20F3N3OS
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Chemical Name:
Penthiopyrad
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Synonyms:
1H-Pyrazole-4-carboxamide,N-[2-(1,3-dimethylbutyl)-3-thienyl]-1-methyl-3-(trifluoromethyl)-;N-[2-(1,3-Dimethylbutyl)-3-thienyl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide;MTF 753;Penthiopyrad;DPX-LEM 17;Gaia;Vertisan;Fontelis;1135441-67-6
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CAS No:
Description
1-methyl-N-[2-(4-methylpentan-2-yl)-3-thienyl]-3-(trifluoromethyl)pyrazole-4-carboxamide is an aromatic amide obtained by formal condensation of the carboxy group of 1-methyl-3-(trifluoromethyl)pyrazole-4-carboxylic acid with the amino group of 2-(4-methylpentan-2-yl)thiophen-3-amine. It is an aromatic amide, an organofluorine compound, a member of pyrazoles and a member of thiophenes.
Characteristics
75.16000
4.97530
1.3g/cm3
103-105ºC
381.3ºC at 760mmHg
184.4ºC
1.561
5.13E-06mmHg at 25°C
Safety Information
|Warning|H400: Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]|P273, P391, and P501|H400 (83.9%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]|Aggregated GHS information provided by 236 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|H410: Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]|Danger|H314: Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P261, P264, P271, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P363, P403+P233, P405, and P501
Penthiopyrad Use and Manufacturing
Agrochemicals -> Fungicides|Environmental transformation -> Pesticides (parent, predecessor)
Penthiopyrad has known environmental transformation products that include 753-A-OH, Penthiopyrad metabolite DM-PCA, Penthiopyrad metabolite M11, Penthiopyrad metabolite M12, Penthiopyrad metabolite PAM, and Penthiopyrad metabolite PCA.
Computed Properties
Molecular Weight:359.4
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:359.12791793
Monoisotopic Mass:359.12791793
Topological Polar Surface Area:75.2
Heavy Atom Count:24
Complexity:447
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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