5-Methoxyflavone

C₁₆H₁₂O₃CAS 42079-78-7252.27 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₆H₁₂O₃
Molar mass: 252.27 g/mol
Exact mass: 252.0786 Da
Melting point: 135 °C
logP: 3.47Crippen estimate
Polar surface area: 39.4 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 2

Identifiers

CAS number

42079-78-7

SMILES

COc1cccc2oc(-c3ccccc3)cc(=O)c12

InChIKey

XRQSPUXANRGDAV-UHFFFAOYSA-N

InChI

InChI=1S/C16H12O3/c1-18-13-8-5-9-14-16(13)12(17)10-15(19-14)11-6-3-2-4-7-11/h2-10H,1H3

Weigh it out

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

Names and synonyms

3 names

4H-1-Benzopyran-4-one, 5-methoxy-2-phenyl-
Flavone, 5-methoxy-
5-Methoxy-2-phenyl-4H-1-benzopyran-4-one

Work with 5-Methoxyflavone

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

5,7-Dimethoxyflavone21392-57-472 % similar 5,6,7-Trimethoxy-2-phenyl-4H-1-benzopyran-4-one973-67-168 % similar 5-Hydroxyflavone491-78-160 % similar 5,7,4′-Trimethoxyflavone5631-70-959 % similar Techtochrysin520-28-558 % similar Oroxylin A480-11-556 % similar 3′,4′-Dimethoxyflavone4143-62-855 % similar Beta-naphthoflavone6051-87-253 % similar

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

Same formula

4-(Acryloyloxy)benzophenone22535-49-5 6-Methoxyflavone26964-24-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook