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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H9FO2
Molecular Weight 168.165
Optical Activity ( + )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(4-Fluorophenyl)propanoic acid, (2S)-

SMILES

C[C@H](C(O)=O)C1=CC=C(F)C=C1

InChI

InChIKey=IXSCGBODJGIJNN-LURJTMIESA-N
InChI=1S/C9H9FO2/c1-6(9(11)12)7-2-4-8(10)5-3-7/h2-6H,1H3,(H,11,12)/t6-/m0/s1

HIDE SMILES / InChI

Molecular Formula C9H9FO2
Molecular Weight 168.165
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:56:23 GMT 2025
Edited
by admin
on Wed Apr 02 17:56:23 GMT 2025
Record UNII
RX4MVG6YB4
Record Status Validated (UNII)
Record Version
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Name Type Language
2-(4-Fluorophenyl)propanoic acid, (2S)-
Systematic Name English
(2S)-2-(4-Fluorophenyl)propanoic acid
Preferred Name English
(S)-2-(4-Fluorophenyl)propanoic acid
Systematic Name English
Benzeneacetic acid, 4-fluoro-?-methyl-, (?S)-
Systematic Name English
(?S)-4-Fluoro-?-methylbenzeneacetic acid
Systematic Name English
Benzeneacetic acid, 4-fluoro-?-methyl-, (S)-
Systematic Name English
Code System Code Type Description
CAS
191725-90-3
Created by admin on Wed Apr 02 17:56:23 GMT 2025 , Edited by admin on Wed Apr 02 17:56:23 GMT 2025
PRIMARY
FDA UNII
RX4MVG6YB4
Created by admin on Wed Apr 02 17:56:23 GMT 2025 , Edited by admin on Wed Apr 02 17:56:23 GMT 2025
PRIMARY
PUBCHEM
6950752
Created by admin on Wed Apr 02 17:56:23 GMT 2025 , Edited by admin on Wed Apr 02 17:56:23 GMT 2025
PRIMARY
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