4-(Trifluoromethylthio)benzonitrile

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Names

[ CAS No. ]:
332-26-3

[ Name ]:
4-(Trifluoromethylthio)benzonitrile

[Synonym ]:
Benzonitrile, 4-[(trifluoromethyl)thio]-
p-Cyanophenyl trifluoromethyl sulfide
4-trifluoromethylsulfanyl-benzonitrile
NCR DSXFFF
MFCD00039475
4-[(Trifluoromethyl)thio]benzonitrile
4-Trifluormethylmercapto-benzonitril
4-[(Trifluoromethyl)sulfanyl]benzonitrile
4-(Trifluoromethylthio)benzonitrile

Chemical & Physical Properties

[ Density]:
1.4±0.1 g/cm3

[ Boiling Point ]:
187.6±40.0 °C at 760 mmHg

[ Melting Point ]:
39-43 °C(lit.)

[ Molecular Formula ]:
C8H4F3NS

[ Molecular Weight ]:
203.184

[ Flash Point ]:
67.3±27.3 °C

[ Exact Mass ]:
203.001648

[ PSA ]:
49.09000

[ LogP ]:
3.37

[ Vapour Pressure ]:
0.6±0.4 mmHg at 25°C

[ Index of Refraction ]:
1.517

MSDS

Click to get detail MSDS

Safety Information

[ Personal Protective Equipment ]:
Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter

[ Hazard Codes ]:
T: Toxic;

[ Risk Phrases ]:
R20/21/22

[ Safety Phrases ]:
S26-S36/37/39

[ RIDADR ]:
3276

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Sodium perfluoroacetate
  • 4-Cyanophenylboronic acid
  • cyano derivative of benzenediazonium tetrafluoroborate
  • (Trifluoromethyl)trimethylsilane
  • 4-Iodobenzonitrile

DownStream

  • 4-(trifluoromethylthio)benzoic acid
  • 4-(trifluoromethylsulfonyl)benzonitrile

Related Compounds

  • 4-(TRIFLUOROMETHYLTHIO)TOLUENE
  • 4-(trifluoromethylthio)benzoic acid
  • 4-(Trifluoromethylthio)nitrobenzene
  • 4-TRIFLUOROMETHYLTHIO-BENZOIC ACID ETHYL ESTER
  • 4-(trifluoromethylthio)butan-1-ol
  • 4-(Trifluoromethylthio)benzoyl chloride
  • 3-{3-[(4-bromo-1H-pyrazol-1-yl)methyl]azetidin-1-yl}-6-cyclopropylpyridazine
  • N-tert-butyl-1-{1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperidine-3-carboxamide
  • 2-[3-(2H-1,2,3-triazol-2-yl)azetidin-1-yl]-6-(trifluoromethyl)pyridine
  • N-cyclopropyl-1-{3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl}piperidine-3-carboxamide
  • N-tert-butyl-1-{pyrazolo[1,5-a]pyrazin-4-yl}piperidine-3-carboxamide
  • N-tert-butyl-1-{5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}azetidine-3-carboxamide
  • N-tert-butyl-1-[3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]azetidine-3-carboxamide
  • 2-Amino-3-(2-chloro-6-methylpyridin-3-yl)propan-1-ol
  • 2-{[1-(5-Methyl-1,3-thiazol-2-yl)pyrrolidin-3-yl]methoxy}pyrazine
  • 3-[5-[2-(2,6-Dioxo-3-piperidyl)-1,3-dioxo-isoindolin-4-yl]oxypentoxy]propanoic acid
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