chempirical

(2,6-Difluorophenyl)phenylmethanone

C13H8F2OCAS 59189-51-4218.20 g/mol

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Aryl halideKetone

Properties

Molecular formula
C13H8F2O
Molar mass
218.20 g/mol
Exact mass
218.0543 Da
logP
3.20Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Identifiers

CAS number
59189-51-4
SMILES
O=C(c1ccccc1)c1c(F)cccc1F
InChIKey
KTRGJHDNHIPMEY-UHFFFAOYSA-N
InChI
InChI=1S/C13H8F2O/c14-10-7-4-8-11(15)12(10)13(16)9-5-2-1-3-6-9/h1-8H

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

Names and synonyms

3 names
  • Methanone, (2,6-difluorophenyl)phenyl-
  • 2,6-Difluorobenzophenone
  • (2,6-Difluorophenyl)(phenyl)methanone

Work with (2,6-Difluorophenyl)phenylmethanone

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-Fluorobenzophenone342-24-566 % similar 2,3,4,5,6-Pentafluorobenzophenone1536-23-862 % similar Benzophenone119-61-956 % similar 1,4-Dibenzoylbenzene3016-97-554 % similar 1,3-Dibenzoylbenzene3770-82-954 % similar 4-Fluorobenzophenone345-83-553 % similar 1,2-Dibenzoylbenzene1159-86-050 % similar 4-Chlorobenzophenone134-85-048 % similar

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

Same formula

(2,3-Difluorophenyl)phenylmethanone208173-20-0 2,4′-Difluorobenzophenone342-25-6 3,3′-Difluorobenzophenone345-70-0 4,4'-Difluorobenzophenone345-92-6 (2-Fluorophenyl)(3-fluorophenyl)methanone58139-11-0 (2,4-Difluorophenyl)phenylmethanone85068-35-5 (2,5-Difluorophenyl)phenylmethanone85068-36-6 (3,4-Difluorophenyl)phenylmethanone85118-07-6

Elsewhere

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