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Details

Stereochemistry RACEMIC
Molecular Formula C10H8ClNO2
Molecular Weight 209.629
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(3-chlorophenyl)-3-cyanopropanoic acid

SMILES

OC(=O)CC(C#N)C1=CC(Cl)=CC=C1

InChI

InChIKey=VVVQYTLDHDEJIO-UHFFFAOYSA-N
InChI=1S/C10H8ClNO2/c11-9-3-1-2-7(4-9)8(6-12)5-10(13)14/h1-4,8H,5H2,(H,13,14)

HIDE SMILES / InChI

Approval Year

Name Type Language
3-(3-chlorophenyl)-3-cyanopropanoic acid
Systematic Name English
3-Chloro-β-cyanobenzenepropanoic acid
Systematic Name English
Benzenepropanoic acid, 3-chloro-β-cyano-
Systematic Name English
Code System Code Type Description
PUBCHEM
21538652
Created by admin on Sat Dec 16 19:21:53 GMT 2023 , Edited by admin on Sat Dec 16 19:21:53 GMT 2023
PRIMARY
FDA UNII
6GN4QAV2DN
Created by admin on Sat Dec 16 19:21:53 GMT 2023 , Edited by admin on Sat Dec 16 19:21:53 GMT 2023
PRIMARY
CAS
1267401-93-3
Created by admin on Sat Dec 16 19:21:53 GMT 2023 , Edited by admin on Sat Dec 16 19:21:53 GMT 2023
PRIMARY