U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C13H17ClO2
Molecular Weight 240.726
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Hexyloxybenzoyl chloride

SMILES

CCCCCCOC1=CC=C(C=C1)C(Cl)=O

InChI

InChIKey=DQQOONVCLQZWOY-UHFFFAOYSA-N
InChI=1S/C13H17ClO2/c1-2-3-4-5-10-16-12-8-6-11(7-9-12)13(14)15/h6-9H,2-5,10H2,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
Benzoyl chloride, 4-(hexyloxy)-
Preferred Name English
4-Hexyloxybenzoyl chloride
Systematic Name English
4-(Hexyloxy)benzoyl chloride
Systematic Name English
4-n-Hexyloxybenzoyl chloride
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID6068193
Created by admin on Tue Apr 01 19:20:22 GMT 2025 , Edited by admin on Tue Apr 01 19:20:22 GMT 2025
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ECHA (EC/EINECS)
254-561-3
Created by admin on Tue Apr 01 19:20:22 GMT 2025 , Edited by admin on Tue Apr 01 19:20:22 GMT 2025
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PUBCHEM
170235
Created by admin on Tue Apr 01 19:20:22 GMT 2025 , Edited by admin on Tue Apr 01 19:20:22 GMT 2025
PRIMARY
CAS
39649-71-3
Created by admin on Tue Apr 01 19:20:22 GMT 2025 , Edited by admin on Tue Apr 01 19:20:22 GMT 2025
PRIMARY
FDA UNII
844TDH4A8P
Created by admin on Tue Apr 01 19:20:22 GMT 2025 , Edited by admin on Tue Apr 01 19:20:22 GMT 2025
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