CHEBI:18172 - fluoroacetate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name fluoroacetate
ChEBI ID CHEBI:18172
Definition A haloacetate(1−) resulting from the deprotonation of the carboxy group of fluoroacetic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:14273, CHEBI:24063
Supplier Information
Download Molfile XML SDF
Formula C2H2FO2
Net Charge -1
Average Mass 77.03448
Monoisotopic Mass 77.00443
InChI InChI=1S/C2H3FO2/c3-1-2(4)5/h1H2,(H,4,5)/p-1
InChIKey QEWYKACRFQMRMB-UHFFFAOYSA-M
SMILES [O-]C(=O)CF
ChEBI Ontology
Outgoing fluoroacetate (CHEBI:18172) has functional parent acetate (CHEBI:30089)
fluoroacetate (CHEBI:18172) is a haloacetate(1−) (CHEBI:85638)
fluoroacetate (CHEBI:18172) is conjugate base of fluoroacetic acid (CHEBI:30775)
Incoming sodium fluoroacetate (CHEBI:38699) has part fluoroacetate (CHEBI:18172)
fluoroacetic acid (CHEBI:30775) is conjugate acid of fluoroacetate (CHEBI:18172)
IUPAC Name
fluoroacetate
Synonyms Sources
FCH2CO2 anion NIST Chemistry WebBook
fluoroacetate UniProt
fluoroacetic acid, ion(1−) ChemIDplus
Manual Xrefs Databases
C06108 KEGG COMPOUND
c0801 UM-BBD
View more database links
Registry Numbers Types Sources
323482 Gmelin Registry Number Gmelin
3536125 Beilstein Registry Number Beilstein
3536125 Reaxys Registry Number Reaxys
513-62-2 CAS Registry Number ChemIDplus
513-62-2 CAS Registry Number NIST Chemistry WebBook
Last Modified
05 May 2015