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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H18O2
Molecular Weight 206.2808
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEXYL BENZOATE

SMILES

CCCCCCOC(=O)C1=CC=CC=C1

InChI

InChIKey=UUGLJVMIFJNVFH-UHFFFAOYSA-N
InChI=1S/C13H18O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h5-7,9-10H,2-4,8,11H2,1H3

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Development of a large-volume, membrane-based injection system for gradient elution micro-liquid chromatography.
2006-02-17
Patents

Patents

Name Type Language
N-HEXYL BENZOATE
HSDB  
Preferred Name English
HEXYL BENZOATE
FHFI  
Systematic Name English
N-HEXYL BENZOATE [HSDB]
Common Name English
BENZOIC ACID HEXYL ESTER
Systematic Name English
HEXYL BENZOATE [FHFI]
Common Name English
N-HEXYLBENZOATE
Common Name English
FEMA NO. 3691
Code English
Classification Tree Code System Code
JECFA EVALUATION HEXYL BENZOATE
Created by admin on Mon Mar 31 19:09:52 GMT 2025 , Edited by admin on Mon Mar 31 19:09:52 GMT 2025
Code System Code Type Description
FDA UNII
VR3C36EKJR
Created by admin on Mon Mar 31 19:09:52 GMT 2025 , Edited by admin on Mon Mar 31 19:09:52 GMT 2025
PRIMARY
SMS_ID
300000017285
Created by admin on Mon Mar 31 19:09:52 GMT 2025 , Edited by admin on Mon Mar 31 19:09:52 GMT 2025
PRIMARY
CAS
6789-88-4
Created by admin on Mon Mar 31 19:09:52 GMT 2025 , Edited by admin on Mon Mar 31 19:09:52 GMT 2025
PRIMARY
EPA CompTox
DTXSID9025403
Created by admin on Mon Mar 31 19:09:52 GMT 2025 , Edited by admin on Mon Mar 31 19:09:52 GMT 2025
PRIMARY
JECFA MONOGRAPH
872
Created by admin on Mon Mar 31 19:09:52 GMT 2025 , Edited by admin on Mon Mar 31 19:09:52 GMT 2025
PRIMARY
HSDB
6031
Created by admin on Mon Mar 31 19:09:52 GMT 2025 , Edited by admin on Mon Mar 31 19:09:52 GMT 2025
PRIMARY
PUBCHEM
23235
Created by admin on Mon Mar 31 19:09:52 GMT 2025 , Edited by admin on Mon Mar 31 19:09:52 GMT 2025
PRIMARY
ECHA (EC/EINECS)
229-856-5
Created by admin on Mon Mar 31 19:09:52 GMT 2025 , Edited by admin on Mon Mar 31 19:09:52 GMT 2025
PRIMARY