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> Main
CHEBI:35547 - perfluoroheptanoic acid
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ChEBI Name
perfluoroheptanoic acid
ChEBI ID
CHEBI:35547
Definition
A fluoroalkanoic acid that is perfluorinated heptanoic acid.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C7HF13O2
Net Charge
0
Average Mass
364.06090
Monoisotopic Mass
363.97690
InChI
InChI=1S/C7HF13O2/c8-2(9,1(21)22)3(10,11)4(12,13)5(14,15)6(16,17)7(18,19)20/h(H,21,22)
InChIKey
ZWBAMYVPMDSJGQ-UHFFFAOYSA-N
SMILES
OC(=O)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 (Br
o
nsted 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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
perfluoroheptanoic acid (
CHEBI:35547
)
has functional parent
heptanoic acid (
CHEBI:45571
)
perfluoroheptanoic acid (
CHEBI:35547
)
has functional parent
perfluoroheptane (
CHEBI:38847
)
perfluoroheptanoic acid (
CHEBI:35547
)
has role
environmental contaminant (
CHEBI:78298
)
perfluoroheptanoic acid (
CHEBI:35547
)
has role
xenobiotic (
CHEBI:35703
)
perfluoroheptanoic acid (
CHEBI:35547
)
is a
fluoroalkanoic acid (
CHEBI:35551
)
IUPAC Name
tridecafluoroheptanoic acid
Synonyms
Sources
perfluoro-
n
-heptanoic acid
ChemIDplus
perfluoroheptanoic acid
ChemIDplus
tridecafluoro-1-heptanoic acid
ChemIDplus
Registry Numbers
Types
Sources
1808210
Beilstein Registry Number
Beilstein
1808210
Reaxys Registry Number
Reaxys
375-85-9
CAS Registry Number
ChemIDplus
589811
Gmelin Registry Number
Gmelin
Citations
Types
Sources
24316529
PubMed citation
Europe PMC
24429974
PubMed citation
Europe PMC
24756670
PubMed citation
Europe PMC
Last Modified
12 November 2014