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4-Cyanobenzyl bromide Structure

4-Cyanobenzyl bromide

Chemical Properties

Melting point 115-117 °C(lit.)
Boiling point 143 °C / 12mmHg
Density  1.5466 (rough estimate)
refractive index  1.6550 (estimate)
storage temp.  Inert atmosphere,2-8°C
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Liquid
color  Clear colorless to yellow
Water Solubility  Soluble in chloroform and methanol. Insoluble in water.
BRN  636717
InChI InChI=1S/C8H6BrN/c9-5-7-1-3-8(6-10)4-2-7/h1-4H,5H2
InChIKey UMLFTCYAQPPZER-UHFFFAOYSA-N
SMILES C(#N)C1=CC=C(CBr)C=C1
CAS DataBase Reference 17201-43-3(CAS DataBase Reference)
NIST Chemistry Reference «ALPHA»-bromo-p-tolunitrile(17201-43-3)
EPA Substance Registry System Benzonitrile, 4-(bromomethyl)- (17201-43-3)

Safety Information

Hazard Codes  C
Risk Statements  34-42/43
Safety Statements  22-26-36/37/39-45-28A
RIDADR  UN 3261 8/PG 2
WGK Germany  3
10-19-21
Hazard Note  Corrosive
TSCA  Yes
HazardClass  8
PackingGroup  II
HS Code  29269090

MSDS

Usage And Synthesis

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