1813-33-8

Name 2-Chloro-4-(trifluoromethyl)benzonitrile
CAS 1813-33-8
Molecular Formula C8H3ClF3N
MDL Number MFCD00084939
Molecular Weight 205.56
MOL File 1813-33-8.mol
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Chemical Properties

Appearance white to light yellow crystal powder
Melting point  82-83°C/8mm
Boiling point  192-193 °C(lit.)
density  1.389 g/mL at 25 °C(lit.)
refractive index  n20/D 1.4840(lit.)
Fp  >220 °F
storage temp.  Sealed in dry,Room Temperature
form  fused solid
color  White
InChI InChI=1S/C8H3ClF3N/c9-7-3-6(8(10,11)12)2-1-5(7)4-13/h1-3H
InChIKey GEHMLBFNZKJDQM-UHFFFAOYSA-N
SMILES C(#N)C1=CC=C(C(F)(F)F)C=C1Cl
CAS DataBase Reference 1813-33-8(CAS DataBase Reference)

Safety Data

Hazard Codes  Xn,T,Xi
Risk Statements 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S36:Wear suitable protective clothing .
RIDADR  3276
WGK Germany  3
Hazard Note  Toxic
HazardClass  6.1
PackingGroup  III
HS Code  2926907090
Storage Class 10 - Combustible liquids

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