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Details

Stereochemistry RACEMIC
Molecular Formula C10H11BrO2
Molecular Weight 243.097
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Bromo-4-phenylbutyric acid

SMILES

OC(=O)C(Br)CCC1=CC=CC=C1

InChI

InChIKey=DJQJKQPODCNTSE-UHFFFAOYSA-N
InChI=1S/C10H11BrO2/c11-9(10(12)13)7-6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,12,13)

HIDE SMILES / InChI

Approval Year

Name Type Language
2-Bromo-4-phenylbutanoic acid
Preferred Name English
2-Bromo-4-phenylbutyric acid
Systematic Name English
Benzenebutanoic acid, ?-bromo-
Systematic Name English
?-Bromobenzenebutanoic acid
Systematic Name English
Code System Code Type Description
CAS
16503-46-1
Created by admin on Wed Apr 02 09:15:11 GMT 2025 , Edited by admin on Wed Apr 02 09:15:11 GMT 2025
PRIMARY
PUBCHEM
86020
Created by admin on Wed Apr 02 09:15:11 GMT 2025 , Edited by admin on Wed Apr 02 09:15:11 GMT 2025
PRIMARY
FDA UNII
U449QZ2DKZ
Created by admin on Wed Apr 02 09:15:11 GMT 2025 , Edited by admin on Wed Apr 02 09:15:11 GMT 2025
PRIMARY
EPA CompTox
DTXSID60937025
Created by admin on Wed Apr 02 09:15:11 GMT 2025 , Edited by admin on Wed Apr 02 09:15:11 GMT 2025
PRIMARY