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Details

Stereochemistry ACHIRAL
Molecular Formula C10H11ClO2
Molecular Weight 198.646
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 3-(4-chlorophenyl)propanoate

SMILES

COC(=O)CCC1=CC=C(Cl)C=C1

InChI

InChIKey=YWDQMQUSUGZXMK-UHFFFAOYSA-N
InChI=1S/C10H11ClO2/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-3,5-6H,4,7H2,1H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
Methyl 3-(4-chlorophenyl)propanoate
Systematic Name English
4-Chlorobenzenepropanoic acid methyl ester
Preferred Name English
Hydrocinnamic acid, p-chloro-, methyl ester
Systematic Name English
Methyl 3-(4-chlorophenyl)propionate
Systematic Name English
Benzenepropanoic acid, 4-chloro-, methyl ester
Systematic Name English
Methyl p-chlorophenylpropanoate
Systematic Name English
Methyl 4-chlorobenzenepropanoate
Systematic Name English
Code System Code Type Description
PUBCHEM
8027172
Created by admin on Wed Apr 02 18:27:37 GMT 2025 , Edited by admin on Wed Apr 02 18:27:37 GMT 2025
PRIMARY
CAS
50561-69-8
Created by admin on Wed Apr 02 18:27:37 GMT 2025 , Edited by admin on Wed Apr 02 18:27:37 GMT 2025
PRIMARY
FDA UNII
TX7X2V9HVC
Created by admin on Wed Apr 02 18:27:37 GMT 2025 , Edited by admin on Wed Apr 02 18:27:37 GMT 2025
PRIMARY
NIH
NCATS
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