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Details

Stereochemistry ACHIRAL
Molecular Formula C10H9ClO4
Molecular Weight 228.629
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(4-Chlorobenzyl)malonic acid

SMILES

OC(=O)C(CC1=CC=C(Cl)C=C1)C(O)=O

InChI

InChIKey=QNZGBKFZLKIUPN-UHFFFAOYSA-N
InChI=1S/C10H9ClO4/c11-7-3-1-6(2-4-7)5-8(9(12)13)10(14)15/h1-4,8H,5H2,(H,12,13)(H,14,15)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
2-(4-Chlorobenzyl)malonic acid
Systematic Name English
Malonic acid, (p-chlorobenzyl)-
Preferred Name English
2-[(4-Chlorophenyl)methyl]propanedioic acid
Systematic Name English
(4-Chlorobenzyl)propanedioic Acid
Systematic Name English
Propanedioic acid, [(4-chlorophenyl)methyl]-
Systematic Name English
Code System Code Type Description
FDA UNII
G3KV4J7ABD
Created by admin on Wed Apr 02 21:23:37 GMT 2025 , Edited by admin on Wed Apr 02 21:23:37 GMT 2025
PRIMARY
CAS
21405-64-1
Created by admin on Wed Apr 02 21:23:37 GMT 2025 , Edited by admin on Wed Apr 02 21:23:37 GMT 2025
PRIMARY
PUBCHEM
2785145
Created by admin on Wed Apr 02 21:23:37 GMT 2025 , Edited by admin on Wed Apr 02 21:23:37 GMT 2025
PRIMARY
NIH
NCATS
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