Perfluorodecanoic acid
Synonyms: Perfluorodecanoic acid, "Nonadecafluorodecanoic acid", "Ndfda", "PFDA", "Perfluoro-N-decanoic acid", "Nonadecafluoro-n-decanoic acid", "NONADECAFLUORO-", "2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Nonadecafluorodecanoic acid", "Perfluorocapric acid", "Decanoic acid, 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-nonadecafluoro-", "C10HF19O2", "Nonadecafluorocapric acid"
Source: perfluorodecanoic acid is a member of a class of perfluorinated alkanoic acids commonly used as lubricants, plasticizers, wetting agents and corrosion, as well as emulsifiers and surfactants in fluoropolymer manufacturing.
Identifiers:
IUPAC Name: 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-nonadecafluorodecanoic acid
CAS Number: 335-76-2
PubChem ID: 9555
InChiKey: PCIUEQPBYFRTEM-UHFFFAOYSA-N
Canonical SMILES: C(=O)(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)O
Structural Properties:
Molecular Formula: C10HF19O2
Molecular Weight: 514,080
Pharmacophore Features:
Number of bond donors: 1
Number of bond acceptors: 21
Number of atoms different from hydrogen: 31
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2D structure (.sdf)
3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)
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Evidence Supporting This Chemical as an Emerging Contaminant
Christensen, K. Y., Raymond, M., Thompson, B. A., & Anderson, H. A. (2016). Perfluoroalkyl substances in older male anglers in Wisconsin. Environment international, 91, 312-318.