CHEBI:20364 - 4-fluorobenzoic acid

ChEBI IDCHEBI:20364
ChEBI Name4-fluorobenzoic acid
Stars
DefinitionA fluorobenzoic acid carrying a fluoro substituent at position 4.
Last Modified28 July 2014
DownloadsMolfile
FormulaC7H5FO2
Net Charge0
Average Mass140.113
Monoisotopic Mass140.02736
SMILESO=C(O)c1ccc(F)cc1
InChIInChI=1S/C7H5FO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)
InChIKeyBBYDXOIZLAWGSL-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
bacterial xenobiotic metabolite  Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
ChEBI Ontology
Outgoing Relation(s)
4-fluorobenzoic acid (CHEBI:20364) has role bacterial xenobiotic metabolite (CHEBI:76976)
4-fluorobenzoic acid (CHEBI:20364) is a fluorobenzoic acid (CHEBI:24071)
4-fluorobenzoic acid (CHEBI:20364) is conjugate acid of 4-fluorobenzoate (CHEBI:27893)
Incoming Relation(s)
4-fluorobenzoyl-CoA (CHEBI:27677) has functional parent 4-fluorobenzoic acid (CHEBI:20364)
4-fluorobenzoate (CHEBI:27893) is conjugate base of 4-fluorobenzoic acid (CHEBI:20364)
IUPAC Name 
4-fluorobenzoic acid
Synonyms  Source
4-Fluorobenzoic acidKEGG COMPOUND
p-fluorobenzoic acidChemIDplus
para-fluorobenzoic acidNIST Chemistry WebBook
Manual XrefsDatabases
C02371KEGG COMPOUND
4-Fluorobenzoic_acidWikipedia
Registry NumbersSources
Reaxys:1906922Reaxys
CAS:456-22-4ChemIDplus
CAS:456-22-4NIST Chemistry WebBook
CAS:456-22-4KEGG COMPOUND
Citations