CHEBI:83493 - perfluoroundecanoic acid

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ChEBI Name perfluoroundecanoic acid
ChEBI ID CHEBI:83493
Definition A fluoroalkanoic acid that is perfluorinated undecanoic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C11HF21O2
Net Charge 0
Average Mass 564.09090
Monoisotopic Mass 563.96412
InChI InChI=1S/C11HF21O2/c12-2(13,1(33)34)3(14,15)4(16,17)5(18,19)6(20,21)7(22,23)8(24,25)9(26,27)10(28,29)11(30,31)32/h(H,33,34)
InChIKey SIDINRCMMRKXGQ-UHFFFAOYSA-N
SMILES OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
Roles Classification
Chemical Role(s): 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 (Bronsted base).
(via oxoacid )
Biological Role(s): 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.
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ChEBI Ontology
Outgoing perfluoroundecanoic acid (CHEBI:83493) has functional parent undecanoic acid (CHEBI:32368)
perfluoroundecanoic acid (CHEBI:83493) has role environmental contaminant (CHEBI:78298)
perfluoroundecanoic acid (CHEBI:83493) has role xenobiotic (CHEBI:35703)
perfluoroundecanoic acid (CHEBI:83493) is a fluoroalkanoic acid (CHEBI:35551)
IUPAC Name
henicosafluoroundecanoic acid
Registry Numbers Types Sources
2058-94-8 CAS Registry Number ChemIDplus
2318888 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
24418714 PubMed citation Europe PMC
24486970 PubMed citation Europe PMC
24952613 PubMed citation Europe PMC
Last Modified
12 November 2014