CHEBI:83491 - perfluoropentanoic acid

ChEBI IDCHEBI:83491
ChEBI Nameperfluoropentanoic acid
Stars
DefinitionA monocarboxylic acid that is perfluorinated pentanoic acid.
Last Modified9 December 2016
DownloadsMolfile
FormulaC5HF9O2
Net Charge0
Average Mass264.043
Monoisotopic Mass263.98328
SMILESO=C(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C5HF9O2/c6-2(7,1(15)16)3(8,9)4(10,11)5(12,13)14/h(H,15,16)
InChIKeyCXZGQIAOTKWCDB-UHFFFAOYSA-N
Roles Classification
Chemical Roles:
environmental contaminant  Any minor or unwanted substance introduced into the environment that can have undesired effects.
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
xenobiotic  A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
ChEBI Ontology
Outgoing Relation(s)
perfluoropentanoic acid (CHEBI:83491) has functional parent valeric acid (CHEBI:17418)
perfluoropentanoic acid (CHEBI:83491) has role environmental contaminant (CHEBI:78298)
perfluoropentanoic acid (CHEBI:83491) has role xenobiotic (CHEBI:35703)
perfluoropentanoic acid (CHEBI:83491) is a fluoroalkanoic acid (CHEBI:35551)
IUPAC Name 
nonafluoropentanoic acid
Synonyms  Source
perfluorovaleric acidChemIDplus
nonafluoro-1-pentanoic acidChemIDplus
2,2,3,3,4,4,5,5,5-nonafluoropentanoic acidChemIDplus
Registry NumbersSources
Reaxys:1800087Reaxys
CAS:2706-90-3ChemIDplus
Citations