2-Bromo-ε-oxobenzenehexanenitrile

CAS Registry Number®

884504-62-5
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CAS Name

2-Bromo-ε-oxobenzenehexanenitrile

Molecular Formula

C12H12BrNO

Molecular Mass

266.13

Cite this Page

2-Bromo-ε-oxobenzenehexanenitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=884504-62-5 (retrieved 2024-07-08) (CAS RN: 884504-62-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    163-164 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H12BrNO/c13-11-7-4-3-6-10(11)12(15)8-2-1-5-9-14/h3-4,6-7H,1-2,5,8H2

InChIKey

InChIKey=WNKOYLWJIKUNRJ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CCCCCC(=O)C=1C=CC=CC1Br

Other Names for this Substance

  • Benzenehexanenitrile, 2-bromo-ε-oxo-
  • 2-Bromo-ε-oxobenzenehexanenitrile