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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H8N2
Molecular Weight 132.1625
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(Aminomethyl)benzonitrile

SMILES

NCC1=C(C=CC=C1)C#N

InChI

InChIKey=IQKCOMKWSLYAHJ-UHFFFAOYSA-N
InChI=1S/C8H8N2/c9-5-7-3-1-2-4-8(7)6-10/h1-4H,5,9H2

HIDE SMILES / InChI

Approval Year

Name Type Language
2-(Aminomethyl)benzonitrile
Systematic Name English
2-Aminomethylbenzonitrile
Preferred Name English
o-Cyanobenzylamine
Systematic Name English
Benzonitrile, 2-(aminomethyl)-
Systematic Name English
2-Cyanobenzylamine
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50625000
Created by admin on Wed Apr 02 19:59:59 GMT 2025 , Edited by admin on Wed Apr 02 19:59:59 GMT 2025
PRIMARY
CAS
344957-25-1
Created by admin on Wed Apr 02 19:59:59 GMT 2025 , Edited by admin on Wed Apr 02 19:59:59 GMT 2025
PRIMARY
FDA UNII
V8GZ3JKM3D
Created by admin on Wed Apr 02 19:59:59 GMT 2025 , Edited by admin on Wed Apr 02 19:59:59 GMT 2025
PRIMARY
PUBCHEM
22341739
Created by admin on Wed Apr 02 19:59:59 GMT 2025 , Edited by admin on Wed Apr 02 19:59:59 GMT 2025
PRIMARY