6:2 Fluorotelomer unsaturated carboxylic acid

Synonyms: "6:2 fluorotelomer unsaturated carboxylic acid", "3,4,4,5,5,6,6,7,7,8,8,8-dodecafluorooct-2-enoic acid"

Source: 6:2 Fluorotelomer unsaturated carboxylic acid (FTUCA) is a metabolite of 8:2 FTOH, a material used in the manufacture of fluorotelomer-based products.

Identifiers:

IUPAC Name: (Z)-3,4,4,5,5,6,6,7,7,8,8,8-dodecafluorooct-2-enoic acid
CAS Number: n/a
PubChem ID: 86290106
InChiKey: BKOBFLVYTXYFQZ-UPHRSURJSA-N
Canonical SMILES: C(=C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)F)C(=O)O

Structural Properties:

Molecular Formula: C₈H₂F₁₂O₂
Molecular Weight: 358.08

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 14
Number of atoms different from hydrogen: 22

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3D structure (.sdf)
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Evidence Supporting This Chemical as an Emerging Contaminant

Barroso, P. J., Santos, J. L., Mart?n, J., Aparicio, I., & Alonso, E. (2019). Emerging contaminants in the atmosphere: Analysis, occurrence and future challenges. Critical Reviews in Environmental Science and Technology, 49(2), 104-171.

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2D-structure

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