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CHEBI:83541 - perfluorodecyl phosphate

ChEBI IDCHEBI:83541
ChEBI Nameperfluorodecyl phosphate
Stars
DefinitionA monoalkyl phosphate in which the alkyl group specified is perfluorodecyl.
Last Modified19 November 2014
DownloadsMolfile
FormulaC10H6F17O4P
Net Charge0
Average Mass544.094
Monoisotopic Mass543.97323
SMILESO=P(O)(O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H6F17O4P/c11-3(12,1-2-31-32(28,29)30)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)9(23,24)10(25,26)27/h1-2H2,(H2,28,29,30)
InChIKeyMIABSAQIFYEDJP-UHFFFAOYSA-N
Roles Classification
Chemical Role:
environmental contaminant  Any minor or unwanted substance introduced into the environment that can have undesired effects.
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)
perfluorodecyl phosphate (CHEBI:83541) has role environmental contaminant (CHEBI:78298)
perfluorodecyl phosphate (CHEBI:83541) has role xenobiotic (CHEBI:35703)
perfluorodecyl phosphate (CHEBI:83541) is a monoalkyl phosphate (CHEBI:25381)
IUPAC Name 
3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl dihydrogen phosphate
Registry NumbersSources
Reaxys:11121027Reaxys