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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H24O2
Molecular Weight 200.3178
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUTYL OCTANOATE

SMILES

CCCCCCCC(=O)OCCCC

InChI

InChIKey=PSXNDMJWRZYVTM-UHFFFAOYSA-N
InChI=1S/C12H24O2/c1-3-5-7-8-9-10-12(13)14-11-6-4-2/h3-11H2,1-2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
BUTYL OCTANOATE
Systematic Name English
NSC-23740
Preferred Name English
N-BUTYL OCTANOATE
Systematic Name English
OCTANOIC ACID, BUTYL ESTER
Common Name English
BUTYL CAPRYLATE
Common Name English
Code System Code Type Description
PUBCHEM
11517
Created by admin on Mon Mar 31 22:10:17 GMT 2025 , Edited by admin on Mon Mar 31 22:10:17 GMT 2025
PRIMARY
FDA UNII
4I64Y9N2WO
Created by admin on Mon Mar 31 22:10:17 GMT 2025 , Edited by admin on Mon Mar 31 22:10:17 GMT 2025
PRIMARY
EPA CompTox
DTXSID0060432
Created by admin on Mon Mar 31 22:10:17 GMT 2025 , Edited by admin on Mon Mar 31 22:10:17 GMT 2025
PRIMARY
NSC
23740
Created by admin on Mon Mar 31 22:10:17 GMT 2025 , Edited by admin on Mon Mar 31 22:10:17 GMT 2025
PRIMARY
CAS
589-75-3
Created by admin on Mon Mar 31 22:10:17 GMT 2025 , Edited by admin on Mon Mar 31 22:10:17 GMT 2025
PRIMARY
CHEBI
89561
Created by admin on Mon Mar 31 22:10:17 GMT 2025 , Edited by admin on Mon Mar 31 22:10:17 GMT 2025
PRIMARY
CHEBI
87380
Created by admin on Mon Mar 31 22:10:17 GMT 2025 , Edited by admin on Mon Mar 31 22:10:17 GMT 2025
PRIMARY
ECHA (EC/EINECS)
209-659-0
Created by admin on Mon Mar 31 22:10:17 GMT 2025 , Edited by admin on Mon Mar 31 22:10:17 GMT 2025
PRIMARY