2,3,4,5,6-Pentafluorobenzophenone

C₁₃H₅F₅OCAS 1536-23-8272.17 g/mol

Open in Covalent MOL file

Aryl halide Ketone

Properties

Molecular formula: C₁₃H₅F₅O
Molar mass: 272.17 g/mol
Exact mass: 272.0261 Da
Melting point: 37 °C
Boiling point: 93 °C
logP: 3.61Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 2

Identifiers

CAS number

1536-23-8

SMILES

O=C(c1ccccc1)c1c(F)c(F)c(F)c(F)c1F

InChIKey

HCCPWBWOSASKLG-UHFFFAOYSA-N

InChI

InChI=1S/C13H5F5O/c14-8-7(9(15)11(17)12(18)10(8)16)13(19)6-4-2-1-3-5-6/h1-5H

Weigh it out

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

Names and synonyms

7 names

Methanone, (2,3,4,5,6-pentafluorophenyl)phenyl-
Benzophenone, 2,3,4,5,6-pentafluoro-
Methanone, (pentafluorophenyl)phenyl-
(2,3,4,5,6-Pentafluorophenyl)phenylmethanone
Benzoylpentafluorobenzene
(Perfluorophenyl)(phenyl)methanone
(Pentafluorophenyl)(phenyl)methanone

Work with 2,3,4,5,6-Pentafluorobenzophenone

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

(2,6-Difluorophenyl)phenylmethanone59189-51-462 % similar Decafluorobenzophenone853-39-458 % similar 1,4-Dibenzoylbenzene3016-97-556 % similar 4-Fluorobenzophenone345-83-555 % similar (2,3-Difluorophenyl)phenylmethanone208173-20-055 % similar 1,2-Dibenzoylbenzene1159-86-052 % similar 2-Fluorobenzophenone342-24-552 % similar 4-Hydroxybenzophenone1137-42-450 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook