U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C10H11FO2
Molecular Weight 182.1915
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(4-Fluorophenyl)butyric Acid

SMILES

OC(=O)CCCC1=CC=C(F)C=C1

InChI

InChIKey=XVQYBBYOYJXQBF-UHFFFAOYSA-N
InChI=1S/C10H11FO2/c11-9-6-4-8(5-7-9)2-1-3-10(12)13/h4-7H,1-3H2,(H,12,13)

HIDE SMILES / InChI

Molecular Formula C10H11FO2
Molecular Weight 182.1915
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 19:18:29 GMT 2025
Edited
by admin
on Tue Apr 01 19:18:29 GMT 2025
Record UNII
FH9535EGU6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(P-FLUOROPHENYL)BUTYRIC ACID
Preferred Name English
4-(4-Fluorophenyl)butyric Acid
Systematic Name English
4-Fluorobenzenebutanoic acid
Systematic Name English
Benzenebutanoic acid, 4-fluoro-
Systematic Name English
NSC-409583
Code English
Code System Code Type Description
FDA UNII
FH9535EGU6
Created by admin on Tue Apr 01 19:18:29 GMT 2025 , Edited by admin on Tue Apr 01 19:18:29 GMT 2025
PRIMARY
ECHA (EC/EINECS)
209-631-8
Created by admin on Tue Apr 01 19:18:29 GMT 2025 , Edited by admin on Tue Apr 01 19:18:29 GMT 2025
PRIMARY
EPA CompTox
DTXSID50207628
Created by admin on Tue Apr 01 19:18:29 GMT 2025 , Edited by admin on Tue Apr 01 19:18:29 GMT 2025
PRIMARY
PUBCHEM
68524
Created by admin on Tue Apr 01 19:18:29 GMT 2025 , Edited by admin on Tue Apr 01 19:18:29 GMT 2025
PRIMARY
NSC
409583
Created by admin on Tue Apr 01 19:18:29 GMT 2025 , Edited by admin on Tue Apr 01 19:18:29 GMT 2025
PRIMARY
CAS
589-06-0
Created by admin on Tue Apr 01 19:18:29 GMT 2025 , Edited by admin on Tue Apr 01 19:18:29 GMT 2025
PRIMARY