4,4,5,5,5-Pentafluoro-1-pentanol

C₅H₇F₅OCAS 148043-73-6178.10 g/mol

Open in Covalent MOL file

Alcohol Alkyl halide

Properties

Molecular formula: C₅H₇F₅O
Molar mass: 178.10 g/mol
Exact mass: 178.0417 Da
logP: 1.96Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 3

Identifiers

CAS number

148043-73-6

SMILES

OCCCC(F)(F)C(F)(F)F

InChIKey

QROUUECTKRZFHF-UHFFFAOYSA-N

InChI

InChI=1S/C5H7F5O/c6-4(7,2-1-3-11)5(8,9)10/h11H,1-3H2

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

Names and synonyms

2 names

1-Pentanol, 4,4,5,5,5-pentafluoro-
4,4,5,5,5-Pentafluoropentanol

Work with 4,4,5,5,5-Pentafluoro-1-pentanol

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4,4,5,5,6,6,7,7,8,8,9,9,9-Tridecafluoro-1-nonanol80806-68-465 % similar 9-[(4,4,5,5,5-Pentafluoropentyl)thio]-1-nonanol511545-94-164 % similar 4,4,4-Trifluoro-1-butanol461-18-752 % similar 2-(Perfluorobutyl)ethanol2043-47-248 % similar 2,2,3,3,3-Pentafluoropropanol422-05-948 % similar 2-(Perfluorohexyl)ethanol647-42-746 % similar (Perfluorooctyl)ethanol678-39-746 % similar 1,1,1,2,2-Pentafluoro-4-iodobutane40723-80-644 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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