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

Details

Stereochemistry RACEMIC
Molecular Formula C6H9FO3
Molecular Weight 148.1323
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 2-fluoro-3-oxovalerate

SMILES

CCC(=O)C(F)C(=O)OC

InChI

InChIKey=ZHQHSDROMAJDFS-UHFFFAOYSA-N
InChI=1S/C6H9FO3/c1-3-4(8)5(7)6(9)10-2/h5H,3H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C6H9FO3
Molecular Weight 148.1323
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:18:02 GMT 2025
Edited
by admin
on Wed Apr 02 19:18:02 GMT 2025
Record UNII
LGE835JYU6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Methyl 2-fluoro-3-oxovalerate
Systematic Name English
2-Fluoro-3-oxopentanoic acid methyl ester
Preferred Name English
Pentanoic acid, 2-fluoro-3-oxo-, methyl ester
Systematic Name English
2-Fluoro-3-oxovaleric acid methyl ester
Systematic Name English
Methyl 2-fluoro-3-oxopentanoate
Systematic Name English
Code System Code Type Description
PUBCHEM
10219521
Created by admin on Wed Apr 02 19:18:02 GMT 2025 , Edited by admin on Wed Apr 02 19:18:02 GMT 2025
PRIMARY
FDA UNII
LGE835JYU6
Created by admin on Wed Apr 02 19:18:02 GMT 2025 , Edited by admin on Wed Apr 02 19:18:02 GMT 2025
PRIMARY
CAS
180287-02-9
Created by admin on Wed Apr 02 19:18:02 GMT 2025 , Edited by admin on Wed Apr 02 19:18:02 GMT 2025
PRIMARY
EPA CompTox
DTXSID80436843
Created by admin on Wed Apr 02 19:18:02 GMT 2025 , Edited by admin on Wed Apr 02 19:18:02 GMT 2025
PRIMARY