2,2,3,4,4,4-Hexafluoro-1-butanol
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2,2,3,4,4,4-Hexafluoro-1-butanol
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CAS No:
382-31-0
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Formula:
C4H4F6O
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Chemical Name:
2,2,3,4,4,4-Hexafluoro-1-butanol
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Synonyms:
1-Butanol,2,2,3,4,4,4-hexafluoro-;2,2,3,4,4,4-Hexafluoro-1-butanol;2,2,3,4,4,4-Hexafluorobutanol;2,2,3,4,4,4-Hexafluoro-1-butyl alcohol;H 0649;1H,1H,3H-Hexafluorobutanol
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CAS No:
Characteristics
20.2
1.7
Colorless transparent liquid, with alcohol-like odor
1.557 g/mL at 25 °C(lit.)
68°C
117 °C
125 °F
n20/D 1.312(lit.)
Safety Information
III
3
UN 1987 3/PG 3
3
R20/22;R36/37/38
S26-S36/37/39
Xn:Harmful;
P261-P305 + P351 + P338
H302-H315-H319-H332-H335
2,2,3,4,4,4-Hexafluoro-1-butanol Use and Manufacturing
PFAS (per- and polyfluoroalkyl substances) -> OECD Category
Computed Properties
Molecular Weight:182.06
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:2
Exact Mass:182.01663372
Monoisotopic Mass:182.01663372
Topological Polar Surface Area:20.2
Heavy Atom Count:11
Complexity:129
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2,2,3,4,4,4-Hexafluoro-1-butanol
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