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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H7NO2
Molecular Weight 137.136
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Benzyl nitrite

SMILES

O=NOCC1=CC=CC=C1

InChI

InChIKey=IYYGLLJDALWAMD-UHFFFAOYSA-N
InChI=1S/C7H7NO2/c9-8-10-6-7-4-2-1-3-5-7/h1-5H,6H2

HIDE SMILES / InChI

Approval Year

Name Type Language
Benzyl nitrite
Systematic Name English
Nitrous acid, benzyl ester
Preferred Name English
Phenylmethyl nitrite
Systematic Name English
Nitrous acid, phenylmethyl ester
Common Name English
NSC-26305
Systematic Name English
Code System Code Type Description
PUBCHEM
136744
Created by admin on Wed Apr 02 14:33:28 GMT 2025 , Edited by admin on Wed Apr 02 14:33:28 GMT 2025
PRIMARY
EPA CompTox
DTXSID50239444
Created by admin on Wed Apr 02 14:33:28 GMT 2025 , Edited by admin on Wed Apr 02 14:33:28 GMT 2025
PRIMARY
NSC
26305
Created by admin on Wed Apr 02 14:33:28 GMT 2025 , Edited by admin on Wed Apr 02 14:33:28 GMT 2025
PRIMARY
CAS
935-05-7
Created by admin on Wed Apr 02 14:33:28 GMT 2025 , Edited by admin on Wed Apr 02 14:33:28 GMT 2025
PRIMARY
FDA UNII
XVC6EPA25U
Created by admin on Wed Apr 02 14:33:28 GMT 2025 , Edited by admin on Wed Apr 02 14:33:28 GMT 2025
PRIMARY