chempirical

3′-Hydroxypropiophenone

C9H10O2CAS 13103-80-5150.18 g/mol

Open in Covalent MOL file
OOH
KetonePhenol

Properties

Molecular formula
C9H10O2
Molar mass
150.18 g/mol
Exact mass
150.0681 Da
Melting point
82 °C
logP
1.98Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
2

Identifiers

CAS number
13103-80-5
SMILES
CCC(=O)c1cccc(O)c1
InChIKey
YXOGDBMOFMQLEU-UHFFFAOYSA-N
InChI
InChI=1S/C9H10O2/c1-2-9(11)7-4-3-5-8(10)6-7/h3-6,10H,2H2,1H3

Weigh it out

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

Names and synonyms

6 names
  • 1-Propanone, 1-(3-hydroxyphenyl)-
  • Propiophenone, 3′-hydroxy-
  • 1-(3-Hydroxyphenyl)-1-propanone
  • m-Hydroxypropiophenone
  • NSC 63366
  • (3-Hydroxyphenyl)propan-1-one

Work with 3′-Hydroxypropiophenone

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-Bromo-1-(3-hydroxyphenyl)ethanone2491-37-465 % similar 4′-Hydroxypropiophenone70-70-263 % similar 1-(3-Aminophenyl)-1-propanone1197-05-362 % similar 1-(3-Bromophenyl)-1-propanone19829-31-362 % similar 1-(3-Chlorophenyl)-1-propanone34841-35-562 % similar Propiophenone93-55-058 % similar 3′,4′-Dihydroxypropiophenone7451-98-157 % similar 3′-Methoxypropiophenone37951-49-857 % similar

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

Same formula

Acetanisole100-06-1 4-Ethoxybenzaldehyde10031-82-0 Methyl phenylacetate101-41-7 (2,3-Dihydro-1-benzofuran-5-yl)methanol103262-35-7 2-Phenylethyl formate104-62-1 Hydroxychavicol1126-61-0 3-Methylphenyl acetate122-46-3 Phenyl glycidyl ether122-60-1

Elsewhere

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