chempirical

2-Fluoro-3-(trifluoromethyl)benzophenone

C14H8F4OCAS 207853-70-1268.21 g/mol

Open in Covalent MOL file
OFFFF
Alkyl halideAryl halideKetone

Properties

Molecular formula
C14H8F4O
Molar mass
268.21 g/mol
Exact mass
268.0511 Da
logP
4.08Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Identifiers

CAS number
207853-70-1
SMILES
C1=CC=C(C=C1)C(=O)C2=C(C(=CC=C2)C(F)(F)F)F
InChIKey
QNEOCRQLKSEYEM-UHFFFAOYSA-N
InChI
InChI=1S/C14H8F4O/c15-12-10(7-4-8-11(12)14(16,17)18)13(19)9-5-2-1-3-6-9/h1-8H

Weigh it out

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

Work with 2-Fluoro-3-(trifluoromethyl)benzophenone

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

Phenyl[2-(trifluoromethyl)phenyl]methanone727-99-174 % similar (2,3-Difluorophenyl)phenylmethanone208173-20-062 % similar 2-Fluoro-3-(trifluoromethyl)benzoic acid115029-22-659 % similar 2-Fluoro-3-(trifluoromethyl)benzamide207853-60-959 % similar 1-[2-Fluoro-3-(trifluoromethyl)phenyl]ethan-1-one207853-63-259 % similar 2-Fluoro-3-(trifluoromethyl)benzoyl chloride208173-19-759 % similar Benzoic acid, 2-fluoro-3-(trifluoromethyl)-, sodium salt (1:1)1701446-41-455 % similar 1-[2-Fluoro-3-(trifluoromethyl)phenyl]-1-propanone207986-23-055 % similar

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

Same formula

2-Fluoro-5-(trifluoromethyl)benzophenone199292-40-5 [2-Fluoro-4-(trifluoromethyl)phenyl]phenylmethanone207974-08-1

Elsewhere

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