Perfluorotetradecanoic acid

Synonyms: "perfluoromyristic acid", "Heptacosafluorotetradecanoic acid", "2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosafluorotetradecanoic acid".

Source: Perfluorotetradecanoic acid is used for GC (Gas Chromatography) and LC (Liquid Chromatography) analysis.

Identifiers:

IUPAC Name: 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosafluorotetradecanoic acid
CAS Number: 376-06-7
PubChem ID: 67822
InChiKey: RUDINRUXCKIXAJ-UHFFFAOYSA-N
Canonical SMILES: C(=O)(C(C(C(C(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)(F)F)(F)F)(F)F)(F)F)O

Structural Properties:

Molecular Formula: C₁₄HF₂₇O₂
Molecular Weight: 714.117

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 29
Number of atoms different from hydrogen: 43

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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 Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors

Ren XM, Qin WP, Cao LY, Zhang J, Yang Y, Wan B and Guo LH. 2016. Binding interactions of perfluoroalkyl substances with thyroid hormone transport proteins and potential toxicological implications. Toxicology 366:32-42. DOI: 10.1016/j.tox.2016.08.011. URL: https://www.ncbi.nlm.nih.gov/pubmed/27528273.

Rosenmai AK, Ahrens L, Godec T, Lundqvist J and Oskarsson A. 2017. Relationship between peroxisome proliferator?activated receptor alpha activity and cellular concentration of 14 perfluoroalkyl substances in HepG2 cells. J Appl Toxicol 38(2):219-226. DOI: 10.1002/jat.3515. URL: https://www.ncbi.nlm.nih.gov/pubmed/28857218.