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

Details

Stereochemistry ACHIRAL
Molecular Formula C10H11NO4
Molecular Weight 209.1986
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of M-NITROBENZYL PROPIONATE

SMILES

CCC(=O)OCC1=CC=CC(=C1)[N+]([O-])=O

InChI

InChIKey=WMHOULGTYXECSC-UHFFFAOYSA-N
InChI=1S/C10H11NO4/c1-2-10(12)15-7-8-4-3-5-9(6-8)11(13)14/h3-6H,2,7H2,1H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
M-NITROBENZYL PROPIONATE
Systematic Name English
BENZENEMETHANOL, 3-NITRO-, 1-PROPANOATE
Systematic Name English
(3-NITROPHENYL)METHYL PROPANOATE
Systematic Name English
3-NITROBENZENEMETHANOL ACETATE
Systematic Name English
3-NITROBENZYL PROPANOATE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID10938582
Created by admin on Sat Dec 16 08:55:19 GMT 2023 , Edited by admin on Sat Dec 16 08:55:19 GMT 2023
PRIMARY
CAS
174794-16-2
Created by admin on Sat Dec 16 08:55:19 GMT 2023 , Edited by admin on Sat Dec 16 08:55:19 GMT 2023
PRIMARY
FDA UNII
KXJ9YKT4BZ
Created by admin on Sat Dec 16 08:55:19 GMT 2023 , Edited by admin on Sat Dec 16 08:55:19 GMT 2023
PRIMARY
PUBCHEM
154822
Created by admin on Sat Dec 16 08:55:19 GMT 2023 , Edited by admin on Sat Dec 16 08:55:19 GMT 2023
PRIMARY
NIH
NCATS
PRIVACY ACT
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