1-hexanol, 3,3,4,4,5,5,6,6,6-nonafluoro-

Synonyms: "1H,1H,2H,2H-perfluorohexan-1-ol", "2-(perfluorobutyl)ethanol", "3,3,4,4,5,5,6,6,6-nonafluorohexan-1-ol", "1H,1H,2H,2H-nonafluoro-1-hexanol", "3,3,4,4,5,5,6,6,6-nonafluorohexanol", "1,1,2,2-tetrahydroperfluoro-1-hexanol", "1H,1H,2H,2H-perfluorohexanol", "1H,1H,2H,2H-nonafluorohexan-1-ol", "2-perfluorobutylethanol".

Source: 3,3,4,4,5,5,6,6,6-nonafluorohexan-1-ol is a solvent.

Identifiers:

IUPAC Name: 3,3,4,4,5,5,6,6,6-nonafluorohexan-1-ol
CAS Number: 2043-47-2
PubChem ID: 74883
InChiKey: JCMNMOBHVPONLD-UHFFFAOYSA-N
Canonical SMILES: C(CO)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F

Structural Properties:

Molecular Formula: C₆H₅F₉O
Molecular Weight: 264.091

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 10
Number of atoms different from hydrogen: 16

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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

Liu C, Du Y and Zhou B. 2007. Evaluation of estrogenic activities and mechanism of action of perfluorinated chemicals determined by vitellogenin induction in primary cultured tilapia hepatocytes. Aquatic toxicology 85(4):267-277. DOI: 10.1016/j.aquatox.2007.09.009. URL: https://www.ncbi.nlm.nih.gov/pubmed/17980923.
Rosenmai AK, Taxvig C, Svingen T, Trier X, Vugt?Lussenburg BMA, Pedersen M, Lesna� L, Ja�gou B and Vinggaard AM. 2016. Fluorinated alkyl substances and technical mixtures used in food paper?packaging exhibit endocrine?related activity in vitro. Andrology 4(4):662-672. DOI: 10.1111/andr.12190. URL: https://www.ncbi.nlm.nih.gov/pubmed/27152447.