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

Details

Stereochemistry ACHIRAL
Molecular Formula C11H12O4
Molecular Weight 208.2106
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Acetoxybenzyl acetate

SMILES

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

InChI

InChIKey=ATUFHKJONOEKHQ-UHFFFAOYSA-N
InChI=1S/C11H12O4/c1-8(12)14-7-10-4-3-5-11(6-10)15-9(2)13/h3-6H,7H2,1-2H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
3-Acetoxybenzyl acetate
Systematic Name English
Benzenemethanol, 3-(acetyloxy)-, 1-acetate
Preferred Name English
m-Acetoxybenzyl acetate
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID60853014
Created by admin on Wed Apr 02 16:38:46 GMT 2025 , Edited by admin on Wed Apr 02 16:38:46 GMT 2025
PRIMARY
CAS
57281-56-8
Created by admin on Wed Apr 02 16:38:46 GMT 2025 , Edited by admin on Wed Apr 02 16:38:46 GMT 2025
PRIMARY
FDA UNII
LJP89KU2E4
Created by admin on Wed Apr 02 16:38:46 GMT 2025 , Edited by admin on Wed Apr 02 16:38:46 GMT 2025
PRIMARY
PUBCHEM
10250213
Created by admin on Wed Apr 02 16:38:46 GMT 2025 , Edited by admin on Wed Apr 02 16:38:46 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966