chempirical

Bis(pentafluorophenyl)methanol

C13H2F10OCAS 1766-76-3364.14 g/mol

Open in Covalent MOL file
HOFFFFFFFFFF
AlcoholAryl halide

Properties

Molecular formula
C13H2F10O
Molar mass
364.14 g/mol
Exact mass
363.9946 Da
Melting point
79–80 °C
logP
4.16Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Identifiers

CAS number
1766-76-3
SMILES
OC(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F
InChIKey
WRLLBTKDSCJOBL-UHFFFAOYSA-N
InChI
InChI=1S/C13H2F10O/c14-3-1(4(15)8(19)11(22)7(3)18)13(24)2-5(16)9(20)12(23)10(21)6(2)17/h13,24H

Weigh it out

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

Names and synonyms

6 names
  • Benzenemethanol, 2,3,4,5,6-pentafluoro-α-(2,3,4,5,6-pentafluorophenyl)-
  • Benzhydrol, 2,2′,3,3′,4,4′,5,5′,6,6′-decafluoro-
  • Benzenemethanol, 2,3,4,5,6-pentafluoro-α-(pentafluorophenyl)-
  • 2,3,4,5,6-Pentafluoro-α-(2,3,4,5,6-pentafluorophenyl)benzenemethanol
  • NSC 97029
  • Decafluorobenzhydrol

Work with Bis(pentafluorophenyl)methanol

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

2,3,4,5,6-Pentafluoro-α-phenylbenzenemethanol1944-05-458 % similar 1-(Pentafluorophenyl)ethanol75853-08-650 % similar Hexafluorobenzene392-56-340 % similar Octafluoronaphthalene313-72-433 % similar Decafluorobiphenyl434-90-233 % similar Bis(4-fluorophenyl)methanol365-24-232 % similar Pentafluorobenzyl alcohol440-60-830 % similar Bromopentafluorobenzene344-04-730 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook