3-(6-Chloro-1-oxohexyl)benzonitrile

CAS Registry Number®

898786-74-8
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CAS Name

3-(6-Chloro-1-oxohexyl)benzonitrile

Molecular Formula

C13H14ClNO

Molecular Mass

235.71

Cite this Page

3-(6-Chloro-1-oxohexyl)benzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=898786-74-8 (retrieved 2024-08-17) (CAS RN: 898786-74-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H14ClNO/c14-8-3-1-2-7-13(16)12-6-4-5-11(9-12)10-15/h4-6,9H,1-3,7-8H2

InChIKey

InChIKey=NGXQNSABIMWNEN-UHFFFAOYSA-N

SMILES

C(CCCCCCl)(=O)C1=CC(C#N)=CC=C1

Canonical SMILES

N#CC1=CC=CC(=C1)C(=O)CCCCCCl

Other Names for this Substance

  • Benzonitrile, 3-(6-chloro-1-oxohexyl)-
  • 3-(6-Chloro-1-oxohexyl)benzonitrile