chempirical

2-Hydroxychalcone

C15H12O2CAS 644-78-0224.26 g/mol

Open in Covalent MOL file
OHO
AlkeneKetonePhenol

Properties

Molecular formula
C15H12O2
Molar mass
224.26 g/mol
Exact mass
224.0837 Da
Melting point
153–154 °C
logP
3.29Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
3

Identifiers

CAS number
644-78-0
SMILES
O=C(C=Cc1ccccc1O)c1ccccc1
InChIKey
UDOOPSJCRMKSGL-UHFFFAOYSA-N
InChI
InChI=1S/C15H12O2/c16-14-9-5-4-8-13(14)10-11-15(17)12-6-2-1-3-7-12/h1-11,16H

Weigh it out

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

Names and synonyms

10 names
  • 2-Propen-1-one, 3-(2-hydroxyphenyl)-1-phenyl-
  • Chalcone, 2-hydroxy-
  • 3-(2-Hydroxyphenyl)-1-phenyl-2-propen-1-one
  • 3-(o-Hydroxyphenyl)acrylophenone
  • o-Hydroxystyryl phenyl ketone
  • 1-Phenyl-3-(2-hydroxyphenyl)-2-propenone
  • Salicylideneacetophenone
  • NSC 37432
  • NSC 640539
  • 3-(2-Hydroxyphenyl)-1-phenylpropenone

Work with 2-Hydroxychalcone

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

O-Coumaric acid583-17-560 % similar O-Coumaric acid614-60-860 % similar trans-Chalcone614-47-159 % similar Chalcone94-41-759 % similar 1,4-Diphenyl-2-butene-1,4-dione4070-75-157 % similar trans-1,2-Dibenzoylethylene959-28-457 % similar 1-Phenyl-2-buten-1-one495-41-050 % similar 4-Oxo-4-phenyl-2-butenoic acid583-06-250 % similar

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

Same formula

Dibenzoylmethane120-46-7 2′-Hydroxychalcone1214-47-7 3-[1,1′-Biphenyl]-4-yl-2-propenoic acid13026-23-8 4-Hydroxychalcone20426-12-4 4′-Hydroxychalcone2657-25-2 Phenyl cinnamate2757-04-2 (±)-Flavanone487-26-3 Chalcone epoxide5411-12-1

Elsewhere

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