chempirical

1-(3-Fluoro-2-hydroxyphenyl)ethanone

C8H7FO2CAS 699-92-3154.14 g/mol

Open in Covalent MOL file
OFHO
Aryl halideKetonePhenol

Properties

Molecular formula
C8H7FO2
Molar mass
154.14 g/mol
Exact mass
154.0430 Da
Melting point
72–73 °C
logP
1.73Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Identifiers

CAS number
699-92-3
SMILES
CC(=O)c1cccc(F)c1O
InChIKey
WXTHZWWWCICGAN-UHFFFAOYSA-N
InChI
InChI=1S/C8H7FO2/c1-5(10)6-3-2-4-7(9)8(6)11/h2-4,11H,1H3

Weigh it out

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

Names and synonyms

6 names
  • Ethanone, 1-(3-fluoro-2-hydroxyphenyl)-
  • Acetophenone, 3′-fluoro-2′-hydroxy-
  • 1-(5-Fluoro-6-hydroxyphenyl)ethanone
  • 3′-Fluoro-2′-hydroxyacetophenone
  • 2-Hydroxy-3-fluoroacetophenone
  • 1-(3-Fluoro-2-hydroxyphenyl)ethan-1-one

Work with 1-(3-Fluoro-2-hydroxyphenyl)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

2′-Fluoroacetophenone445-27-265 % similar 3-Amino-2-hydroxyacetophenone70977-72-960 % similar 1-(2,6-Difluorophenyl)ethanone13670-99-056 % similar 2′-Hydroxy-3′-nitroacetophenone28177-69-753 % similar 2,6-Difluorophenol28177-48-252 % similar 4-Acetyl-3-fluorophenol98619-07-951 % similar 2'-Hydroxyacetophenone104809-67-850 % similar 2′-Hydroxyacetophenone118-93-450 % similar

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

Same formula

2-Fluoro-3-methoxybenzaldehyde103438-88-6 2-Fluoro-5-methoxybenzaldehyde105728-90-3 4-Fluoro-3-methoxybenzaldehyde128495-46-5 1-(4-Fluoro-2-hydroxyphenyl)ethanone1481-27-2 α-Fluorobenzeneacetic acid1578-63-8 5-Fluoro-2-methoxybenzaldehyde19415-51-1 3-Fluorophenylacetic acid331-25-9 2-Fluoro-4-methoxybenzaldehyde331-64-6

Elsewhere

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