1-(2,4-Difluorophenyl)ethanone

C₈H₆F₂OCAS 364-83-0156.13 g/mol

Open in Covalent MOL file

Aryl halide Ketone

Properties

Molecular formula: C₈H₆F₂O
Molar mass: 156.13 g/mol
Exact mass: 156.0387 Da
Boiling point: 80–81 °C (at 25 Torr)
logP: 2.17Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation97.9% of notifiers

Aggregated from 47 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

364-83-0

SMILES

CC(=O)c1ccc(F)cc1F

InChIKey

QEWHNJPLPZOEKU-UHFFFAOYSA-N

InChI

InChI=1S/C8H6F2O/c1-5(11)7-3-2-6(9)4-8(7)10/h2-4H,1H3

Weigh it out

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

Names and synonyms

7 names

Ethanone, 1-(2,4-difluorophenyl)-
Acetophenone, 2′,4′-difluoro-
2,4-Difluoroacetophenone
2′,4′-Difluoroacetophenone
2,4-Difluorophenyl methyl ketone
o,p-Difluoroacetophenone
1-(2,4-Difluorophenyl)ethan-1-one

Work with 1-(2,4-Difluorophenyl)ethanone

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

1-(4-Fluoro-2-methoxyphenyl)ethanone51788-80-865 % similar 1-(2-Bromo-4-fluorophenyl)ethanone1006-39-964 % similar 4'-Fluoro-2'-hydroxyacetophenone1481-27-264 % similar 1-(4-Chloro-2-fluorophenyl)ethanone175711-83-864 % similar 1-(4-Bromo-2-fluorophenyl)ethan-1-one625446-22-264 % similar 1-(2-Chloro-4-fluorophenyl)ethanone700-35-664 % similar 4-Acetyl-3-fluorophenol98619-07-964 % similar 2-Fluoro-4-(trifluoromethyl)acetophenone122023-29-460 % similar

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

Same formula

(2S)-2-(3,4-Difluorophenyl)oxirane1006376-63-1 3',5'-Difluoroacetophenone123577-99-1 1-(2,6-Difluorophenyl)ethanone13670-99-0 5,7-Difluoro-2,3-dihydrobenzofuran175203-20-0 2',3'-Difluoroacetophenone18355-80-1 1-(2,5-Difluorophenyl)ethanone1979-36-8 2,3-Difluoro-4-methylbenzaldehyde245536-50-9 1-(3,4-Difluorophenyl)ethanone369-33-5

Elsewhere

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