3-(5-Chloro-1-oxopentyl)benzonitrile
CAS Registry Number®
898786-72-6
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CAS Name
3-(5-Chloro-1-oxopentyl)benzonitrileMolecular Formula
C12H12ClNOMolecular Mass
221.68Cite this Page
3-(5-Chloro-1-oxopentyl)benzonitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=898786-72-6 (retrieved ) (CAS RN: 898786-72-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C12H12ClNO/c13-7-2-1-6-12(15)11-5-3-4-10(8-11)9-14/h3-5,8H,1-2,6-7H2
InChIKey
InChIKey=KCHVCEPXZXVKGG-UHFFFAOYSA-N
SMILES
C(CCCCCl)(=O)C1=CC(C#N)=CC=C1
Canonical SMILES
N#CC1=CC=CC(=C1)C(=O)CCCCCl
Other Names for this Substance
- Benzonitrile, 3-(5-chloro-1-oxopentyl)-
- 3-(5-Chloro-1-oxopentyl)benzonitrile