chempirical

(4-Chlorophenyl)(5-fluoro-2-hydroxyphenyl)methanone

C13H8ClFO2CAS 62433-26-5250.65 g/mol

Open in Covalent MOL file
OClFOH
Aryl halideKetonePhenol

Properties

Molecular formula
C13H8ClFO2
Molar mass
250.65 g/mol
Exact mass
250.0197 Da
Melting point
65–66 °C
logP
3.42Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
2

Identifiers

CAS number
62433-26-5
SMILES
O=C(c1ccc(Cl)cc1)c1cc(F)ccc1O
InChIKey
AYBQWBCUAWOLCT-UHFFFAOYSA-N
InChI
InChI=1S/C13H8ClFO2/c14-9-3-1-8(2-4-9)13(17)11-7-10(15)5-6-12(11)16/h1-7,16H

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Names and synonyms

6 names
  • Methanone, (4-chlorophenyl)(5-fluoro-2-hydroxyphenyl)-
  • SL 79-182
  • SL 79-182-00
  • 4′-Chloro-5-fluoro-2-hydroxybenzophenone
  • 4-Chloro-2′-hydroxy-5′-fluorobenzophenone
  • 2-(4-Chlorobenzoyl)-4-fluorophenol

Work with (4-Chlorophenyl)(5-fluoro-2-hydroxyphenyl)methanone

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-Chlorophenyl)(4-fluorophenyl)methanone1806-23-150 % similar 2-Bromo-1-(5-fluoro-2-hydroxyphenyl)ethanone126581-65-548 % similar (2,5-Difluorophenyl)phenylmethanone85068-36-647 % similar 2-(4-Chlorobenzoyl)benzoic acid85-56-345 % similar (2-Chloro-5-iodophenyl)(4-fluorophenyl)methanone915095-86-245 % similar 2-Hydroxy-5-methylbenzophenone1470-57-144 % similar 2-Chloro-5-fluorobenzoic acid2252-50-844 % similar (2,4-Difluorophenyl)phenylmethanone85068-35-544 % similar

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

Elsewhere

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