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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H15ClO
Molecular Weight 210.7
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Pentylbenzoyl chloride

SMILES

CCCCCC1=CC=C(C=C1)C(Cl)=O

InChI

InChIKey=FBBRKYLXMNQFQU-UHFFFAOYSA-N
InChI=1S/C12H15ClO/c1-2-3-4-5-10-6-8-11(9-7-10)12(13)14/h6-9H,2-5H2,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
4-Pentylbenzoyl chloride
Systematic Name English
Benzoyl chloride, 4-pentyl-
Systematic Name English
Code System Code Type Description
CAS
49763-65-7
Created by admin on Sat Dec 16 20:22:22 GMT 2023 , Edited by admin on Sat Dec 16 20:22:22 GMT 2023
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FDA UNII
4K9R3634UY
Created by admin on Sat Dec 16 20:22:22 GMT 2023 , Edited by admin on Sat Dec 16 20:22:22 GMT 2023
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ECHA (EC/EINECS)
256-478-8
Created by admin on Sat Dec 16 20:22:22 GMT 2023 , Edited by admin on Sat Dec 16 20:22:22 GMT 2023
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EPA CompTox
DTXSID5068520
Created by admin on Sat Dec 16 20:22:22 GMT 2023 , Edited by admin on Sat Dec 16 20:22:22 GMT 2023
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PUBCHEM
170812
Created by admin on Sat Dec 16 20:22:22 GMT 2023 , Edited by admin on Sat Dec 16 20:22:22 GMT 2023
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