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Details

Stereochemistry ACHIRAL
Molecular Formula C10H9ClO3
Molecular Weight 212.63
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(4-Chlorobenzoyl)propionic acid

SMILES

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

InChI

InChIKey=AHVASTJJVAYFPY-UHFFFAOYSA-N
InChI=1S/C10H9ClO3/c11-8-3-1-7(2-4-8)9(12)5-6-10(13)14/h1-4H,5-6H2,(H,13,14)

HIDE SMILES / InChI

Molecular Formula C10H9ClO3
Molecular Weight 212.63
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:12:50 GMT 2025
Edited
by admin
on Tue Apr 01 19:12:50 GMT 2025
Record UNII
DBX7DG4X3P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(4-Chlorobenzoyl)propionic acid
Systematic Name English
AI3-07203
Preferred Name English
NSC-5137
Code English
4-Chloro-?-oxobenzenebutanoic acid
Systematic Name English
?-(p-Chlorobenzoyl)propionic acid
Systematic Name English
3-(p-Chlorobenzoyl)propionic acid
Systematic Name English
4-(4-Chlorophenyl)-4-oxobutanoic acid
Systematic Name English
4-Oxo-4-(4-chlorophenyl)butanoic acid
Systematic Name English
4-(4-Chlorophenyl)-4-oxobutyric acid
Systematic Name English
Benzenebutanoic acid, 4-chloro-?-oxo-
Systematic Name English
?-(4-Chlorobenzoyl)propionic acid
Systematic Name English
3-(4-Chlorobenzoyl)propanoic acid
Systematic Name English
Propionic acid, 3-(p-chlorobenzoyl)-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
223-627-3
Created by admin on Tue Apr 01 19:12:50 GMT 2025 , Edited by admin on Tue Apr 01 19:12:50 GMT 2025
PRIMARY
CAS
3984-34-7
Created by admin on Tue Apr 01 19:12:50 GMT 2025 , Edited by admin on Tue Apr 01 19:12:50 GMT 2025
PRIMARY
EPA CompTox
DTXSID30192902
Created by admin on Tue Apr 01 19:12:50 GMT 2025 , Edited by admin on Tue Apr 01 19:12:50 GMT 2025
PRIMARY
NSC
5137
Created by admin on Tue Apr 01 19:12:50 GMT 2025 , Edited by admin on Tue Apr 01 19:12:50 GMT 2025
PRIMARY
PUBCHEM
77604
Created by admin on Tue Apr 01 19:12:50 GMT 2025 , Edited by admin on Tue Apr 01 19:12:50 GMT 2025
PRIMARY
FDA UNII
DBX7DG4X3P
Created by admin on Tue Apr 01 19:12:50 GMT 2025 , Edited by admin on Tue Apr 01 19:12:50 GMT 2025
PRIMARY