3-Cyanobenzyl bromide

CAS Registry Number®

28188-41-2

CAS Name

3-Cyanobenzyl bromide

Molecular Formula

C8H6BrN

Molecular Mass

196.04

Cite this Page

3-Cyanobenzyl bromide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=28188-41-2 (retrieved 2024-11-21) (CAS RN: 28188-41-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    130 °C @ Press: 4 Torr

  • Melting Point (2)

    93 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H6BrN/c9-5-7-2-1-3-8(4-7)6-10/h1-4H,5H2

InChIKey

InChIKey=CVKOOKPNCVYHNY-UHFFFAOYSA-N

SMILES

C(Br)C1=CC(C#N)=CC=C1

Canonical SMILES

N#CC1=CC=CC(=C1)CBr

Other Names for this Substance

  • Benzonitrile, 3-(bromomethyl)-
  • m-Tolunitrile, α-bromo-
  • 3-(Bromomethyl)benzonitrile
  • m-Cyanobenzyl bromide
  • 3-Cyanobenzyl bromide

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration