1-(2-Hydroxyphenyl)-3-phenyl-1,3-propanedione

C₁₅H₁₂O₃CAS 1469-94-9240.26 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₅H₁₂O₃
Molar mass: 240.26 g/mol
Exact mass: 240.0786 Da
Melting point: 88 °C
logP: 2.85Crippen estimate
Polar surface area: 54.4 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 4

Identifiers

CAS number

1469-94-9

SMILES

O=C(CC(=O)c1ccccc1O)c1ccccc1

InChIKey

OABFIJGAEVKMJP-UHFFFAOYSA-N

InChI

InChI=1S/C15H12O3/c16-13-9-5-4-8-12(13)15(18)10-14(17)11-6-2-1-3-7-11/h1-9,16H,10H2

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Names and synonyms

8 names

1,3-Propanedione, 1-(2-hydroxyphenyl)-3-phenyl-
1,3-Propanedione, 1-(o-hydroxyphenyl)-3-phenyl-
2-o-Hydroxybenzoylacetophenone
2′-Hydroxydibenzoylmethane
α-Benzoyl-2-hydroxyacetophenone
NSC 31881
NSC 631975
1-(2′-Hydroxyphenyl)-3-phenylpropane-1,3-dione

Work with 1-(2-Hydroxyphenyl)-3-phenyl-1,3-propanedione

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

Same formula

2′-Hydroxyflavanone17348-76-4 3-Benzoylbenzeneacetic acid22071-22-3 1-[2-(Benzoyloxy)phenyl]ethanone4010-33-7 (±)-6-Hydroxyflavanone4250-77-5 Methyl O-benzoylbenzoate606-28-0 7-Hydroxyflavanone6515-36-2 4′-Hydroxyflavanone6515-37-3 2-(4-Methylbenzoyl)benzoic acid85-55-2

Elsewhere

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