perfluorododecanoic acid (CHEBI:90633)

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ChEBI Name	perfluorododecanoic acid

ChEBI ID	CHEBI:90633

Definition	A fluoroalkanoic acid that is dodecanoic acid in which all of the hydrogens attached to carbon atoms are replaced by fluorines. It is a highly persistent, bioaccumulative breakdown product of stain- and grease-proof coatings on food packaging, soft furnishings and carpets.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information	ChemicalBook:CB0135735, eMolecules:526705, ZINC000001530331

Download	Molfile XML SDF

Formula

C12HF23O2

Net Charge

Average Mass

614.099

Monoisotopic Mass

613.96093

InChI

InChI=1S/C12HF23O2/c13-2(14,1(36)37)3(15,16)4(17,18)5(19,20)6(21,22)7(23,24)8(25,26)9(27,28)10(29,30)11(31,32)12(33,34)35/h(H,36,37)

InChIKey

CXGONMQFMIYUJR-UHFFFAOYSA-N

SMILES

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

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 )

ChEBI Ontology
Outgoing	perfluorododecanoic acid (CHEBI:90633) has functional parent dodecanoic acid (CHEBI:30805) perfluorododecanoic acid (CHEBI:90633) has role environmental contaminant (CHEBI:78298) perfluorododecanoic acid (CHEBI:90633) is a fluoroalkanoic acid (CHEBI:35551)

IUPAC Name

tricosafluorododecanoic acid

Synonyms	Sources
2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-tricosafluorododecanoic acid	ChemIDplus
C₁₁F₂₃CO₂H	ChEBI
C₁₁F₂₃COOH	ChEBI
n-C₁₁F₂₃CO₂H	ChEBI
n-C₁₁F₂₃COOH	ChEBI
perfluorolauric acid	ChemIDplus
PFDoA	ChEBI

Last Modified

03 December 2015