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

Details

Stereochemistry ACHIRAL
Molecular Formula C14H20O3
Molecular Weight 236.3068
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (4-METHOXYPHENYL)METHYL ESTER HEXANOIC ACID

SMILES

CCCCCC(=O)OCC1=CC=C(OC)C=C1

InChI

InChIKey=IDNYDOYPAOXMOC-UHFFFAOYSA-N
InChI=1S/C14H20O3/c1-3-4-5-6-14(15)17-11-12-7-9-13(16-2)10-8-12/h7-10H,3-6,11H2,1-2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
NSC-53807
Preferred Name English
(4-METHOXYPHENYL)METHYL ESTER HEXANOIC ACID
Systematic Name English
(4-METHOXYPHENYL)METHYL HEXANOATE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID9064423
Created by admin on Tue Apr 01 20:16:32 GMT 2025 , Edited by admin on Tue Apr 01 20:16:32 GMT 2025
PRIMARY
CAS
6624-60-8
Created by admin on Tue Apr 01 20:16:32 GMT 2025 , Edited by admin on Tue Apr 01 20:16:32 GMT 2025
PRIMARY
NSC
53807
Created by admin on Tue Apr 01 20:16:32 GMT 2025 , Edited by admin on Tue Apr 01 20:16:32 GMT 2025
PRIMARY
PUBCHEM
81102
Created by admin on Tue Apr 01 20:16:32 GMT 2025 , Edited by admin on Tue Apr 01 20:16:32 GMT 2025
PRIMARY
FDA UNII
XZ19L9AAO8
Created by admin on Tue Apr 01 20:16:32 GMT 2025 , Edited by admin on Tue Apr 01 20:16:32 GMT 2025
PRIMARY