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401649-63-6

401649-63-6 Structure

401649-63-6 Structure
IdentificationBack Directory
[Name]

4-(TRIFLUOROMETHYL)-1,2-DIHYDRO-6-(4-METHOXYPHENYL)-2-THIOXOPYRIDINE-3-CARBONITRILE
[CAS]

401649-63-6
[Synonyms]

AKOS USSH-4110022
6-(4-methoxyphenyl)-2-sulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile
4-(TRIFLUOROMETHYL)-1,2-DIHYDRO-6-(4-METHOXYPHENYL)-2-THIOXOPYRIDINE-3-CARBONITRILE
6-(4-METHOXYPHENYL)-2-THIOXO-4-(TRIFLUOROMETHYL)-1,2-DIHYDRO-3-PYRIDINECARBONITRILE
3-Pyridinecarbonitrile, 1,2-dihydro-6-(4-methoxyphenyl)-2-thioxo-4-(trifluoromethyl)-
6-(4-methoxyphenyl)-2-sulfanylidene-4-(trifluoromethyl)-1,2-dihydropyridine-3-carbonitrile
[Molecular Formula]

C14H9F3N2OS
[MDL Number]

MFCD03305676
[MOL File]

401649-63-6.mol
[Molecular Weight]

310.29
Chemical PropertiesBack Directory
[Melting point ]

215-217 °C(Solv: ethanol (64-17-5))
[Boiling point ]

354.2±52.0 °C(Predicted)
[density ]

1.43±0.1 g/cm3(Predicted)
[form ]

solid
[pka]

5.88±0.70(Predicted)
[InChI]

1S/C14H9F3N2OS/c1-20-9-4-2-8(3-5-9)12-6-11(14(15,16)17)10(7-18)13(21)19-12/h2-6H,1H3,(H,19,21)
[InChIKey]

WBGOVCCHVXTCRW-UHFFFAOYSA-N
[SMILES]

COC1=CC=C(C2=CC(C(F)(F)F)=C(C(S)=N2)C#N)C=C1
Safety DataBack Directory
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Skin Sens. 1
401649-63-6 suppliers list
Company Name: Sigma-Aldrich  
Telephone: 021-61415566 800-8193336
Website: https://www.sigmaaldrich.cn
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