2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Pentadecafluorooctanoate

Synonyms: perfluorooctanoate, "2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctanoate"

Source: 2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Pentadecafluorooctanoate is a synthetic surfactant used in a variety of industrial applications.

Identifiers:

IUPAC Name: 2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctanoate
CAS Number: n/a
PubChem ID: 4986139
InChiKey: SNGREZUHAYWORS-UHFFFAOYSA-M
Canonical SMILES: C(=O)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)[O-]

Structural Properties:

Molecular Formula: C₈F₁₅O₂^-
Molecular Weight: 413,060

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 17
Number of atoms different from hydrogen: 25

Downloads

2D structure (.sdf)
3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)

Search Similar molecules

Evidence Supporting This Chemical as an Emerging Contaminant

Riva, F., Castiglioni, S., Fattore, E., Manenti, A., Davoli, E., & Zuccato, E. (2018). Monitoring emerging contaminants in the drinking water of Milan and assessment of the human risk. International journal of hygiene and environmental health, 221(3), 451-457.

External Links

PubChem

PubMed (general search)

PubMed (search as emerging contaminant)

2D-structure

3D-structure