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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H6BNO2
Molecular Weight 146.939
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Cyanophenylboronic acid

SMILES

OB(O)C1=CC=CC=C1C#N

InChI

InChIKey=NPLZNDDFVCGRAG-UHFFFAOYSA-N
InChI=1S/C7H6BNO2/c9-5-6-3-1-2-4-7(6)8(10)11/h1-4,10-11H

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
2-Cyanobenzeneboronic acid
Preferred Name English
2-Cyanophenylboronic acid
Systematic Name English
[m-Cyanophenyl-4-yl]boronic acid
Systematic Name English
Boronic acid, B-(2-cyanophenyl)-
Systematic Name English
B-(2-Cyanophenyl)boronic acid
Systematic Name English
Code System Code Type Description
FDA UNII
62Y33C8JKZ
Created by admin on Wed Apr 02 20:31:19 GMT 2025 , Edited by admin on Wed Apr 02 20:31:19 GMT 2025
PRIMARY
CAS
138642-62-3
Created by admin on Wed Apr 02 20:31:19 GMT 2025 , Edited by admin on Wed Apr 02 20:31:19 GMT 2025
PRIMARY
PUBCHEM
2734610
Created by admin on Wed Apr 02 20:31:19 GMT 2025 , Edited by admin on Wed Apr 02 20:31:19 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