2,2,3,3,4,4,4-Heptafluorobutanol

C4H3F7OCAS 375-01-9200.06 g/mol

Open in Covalent MOL file
HOFFFFFFF
AlcoholAlkyl halide

Properties

Molecular formula
C4H3F7O
Molar mass
200.06 g/mol
Exact mass
200.0072 Da
Boiling point
95 °C
logP
1.81Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Hazards

Warning
Flammable (GHS02)Irritant (GHS07)

Aggregated from 60 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number
375-01-9
SMILES
OCC(F)(F)C(F)(F)C(F)(F)F
InChIKey
WXJFKAZDSQLPBX-UHFFFAOYSA-N
InChI
InChI=1S/C4H3F7O/c5-2(6,1-12)3(7,8)4(9,10)11/h12H,1H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

12 names
  • 1-Butanol, 2,2,3,3,4,4,4-heptafluoro-
  • 2,2,3,3,4,4,4-Heptafluoro-1-butanol
  • 1H,1H-Heptafluorobutanol-1
  • 1,1-Dihydroperfluorobutyl alcohol
  • α,α-Dihydroperfluorobutanol
  • Heptafluoro-1,1-dihydrobutyl alcohol
  • 1,1-Dihydroperfluoro-1-butanol
  • (Perfluoropropyl)methanol
  • 1H,1H-Heptafluoro-1-butanol
  • NSC 60528
  • 1H,1H-Heptafluorobutanol
  • Heptafluorobutanol

Work with 2,2,3,3,4,4,4-Heptafluorobutanol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1H,1H-Perfluoro-1-tetradecanol15622-57-881 % similar 1H,1H-Perfluorooctanol307-30-281 % similar 1H,1H-Perfluoro-1-decanol307-37-981 % similar 1H,1H-Perfluoroundecan-1-ol307-46-081 % similar 2,2,3,3,4,4,5,5,6,6,7,7,7-Tridecafluoro-1-heptanol375-82-681 % similar 1H,1H-Perfluoro-1-nonanol423-56-381 % similar 1H,1H-Perfluoro-1-dodecanol423-65-481 % similar 2,2,3,3,4,4,5,5-Octafluorohexane-1,6-diol355-74-874 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Sevoflurane28523-86-6 Methyl perfluoropropyl ether375-03-1 1,1,2,2-Tetrafluoro-1-(2,2,2-trifluoroethoxy)ethane406-78-0

Elsewhere

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