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3-(Trifluoromethyl)benzonitrile Structure

3-(Trifluoromethyl)benzonitrile

Chemical Properties

Melting point 16-20 °C(lit.)
Boiling point 189 °C(lit.)
Density  1.281 g/mL at 25 °C(lit.)
refractive index  n20/D 1.4575(lit.)
Flash point 162 °F
storage temp.  Sealed in dry,Room Temperature
form  powder to lump to clear liquid
color  White or Colorless to Almost white or Almost colorless
Sensitive  Lachrymatory
BRN  1868102
InChI 1S/C8H4F3N/c9-8(10,11)7-3-1-2-6(4-7)5-12/h1-4H
InChIKey OGOBINRVCUWLGN-UHFFFAOYSA-N
SMILES FC(F)(F)c1cccc(c1)C#N
CAS DataBase Reference 368-77-4(CAS DataBase Reference)
NIST Chemistry Reference 3-(CF3)-C6H4-CN(368-77-4)
EPA Substance Registry System 3-(Trifluoromethyl)benzonitrile (368-77-4)

Safety Information

Hazard Codes  Xn
Risk Statements  20/21/22-36/38
Safety Statements  45-36-36/37-26
RIDADR  3276
WGK Germany  3
Hazard Note  Lachrymatory
HazardClass  6.1
PackingGroup  III
HS Code  29269095
Storage Class 10 - Combustible liquids
Hazard Classifications Acute Tox. 4 Dermal
Acute Tox. 4 Oral
STOT SE 3

MSDS

Usage And Synthesis

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