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6-Phenyl-2-Thioxo-4-(Trifluoromethyl)-1,2-Dihydro-3-Pyridinecarbonitrile
[CAS# 104960-49-8]

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Identification
Name 6-Phenyl-2-Thioxo-4-(Trifluoromethyl)-1,2-Dihydro-3-Pyridinecarbonitrile
Synonyms 2-mercapto-5-methyl-3,6-diphenylthieno[2,3-d]pyrimidin-4(3H)-one; 2-Mercapto-6-phenyl-4-(trifluoromethyl)-nicotinonitrile; 2-MERCAPTO-6-PHENYL-4-(TRIFLUOROMETHYL)NICOTINONITRILE
Molecular Structure CAS#: 104960-49-8, 6-Phenyl-2-Thioxo-4-(Trifluoromethyl)-1,2-Dihydro-3-Pyridinecarbonitrile
Molecular Formula C13H7F3N2S
Molecular Weight 280.27
CAS Registry Number 104960-49-8
SMILES N#C\C2=C(\C=C(\c1ccccc1)NC2=S)C(F)(F)F
InChI 1S/C13H7F3N2S/c14-13(15,16)10-6-11(8-4-2-1-3-5-8)18-12(19)9(10)7-17/h1-6H,(H,18,19)
InChIKey HZBJUXYKUJPFFA-UHFFFAOYSA-N
Properties
Density 1.438g/cm3 (Cal.)
Melting point 181°C (Expl.)
Boiling point 316.935°C at 760 mmHg (Cal.)
Flash point 145.478°C (Cal.)
Refractive index 1.607 (Cal.)
Safety Data
Safety Description Irritant
S24/25,S36/37/39,S45
IRRITANT
R36/37/38
SDS Available
Market Analysis Reports
List of Reports Available for 6-Phenyl-2-Thioxo-4-(Trifluoromethyl)-1,2-Dihydro-3-Pyridinecarbonitrile
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