(Tridecafluorohexyl)phosphonic acid

Synonyms: perfluorohexylphosphonic acid

Source: Perfluorohexylphosphonic acid (PFHxPA) is part of the group of Polyfluoroalkyl Substances (PFASs), which are widely used in the industry.

Identifiers:

IUPAC Name: 1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexylphosphonic acid
CAS Number: 40143-76-8
PubChem ID: 15930820
InChiKey: AGCUFKNHQDVTAD-UHFFFAOYSA-N
Canonical SMILES: C(C(C(C(F)(F)P(=O)(O)O)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F

Structural Properties:

Molecular Formula: C₆H₂F₁₃O₃P
Molecular Weight: 400,030

Pharmacophore Features:

Number of bond donors: 2
Number of bond acceptors: 16
Number of atoms different from hydrogen: 23

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Evidence Supporting This Chemical as an Emerging Contaminant

Hradkova, P., Poustka, J., Hlou?kov?, V., Pulkrabova, J., Tomaniova, M., & Haj?lov?, J. (2010). Perfluorinated compounds: occurrence of emerging food contaminants in canned fish and seafood products. Czech journal of food sciences, 28(4), 333-342.

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