Chemical Properties of 4'-Methoxy-5,7-dihydroxy isoflavone (CAS 491-80-5)

4'-Methoxy-5,7-dihydroxy isoflavone

InChI
InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)12-8-21-14-7-10(17)6-13(18)15(14)16(12)19/h2-8,17-18H,1H3
InChI Key
WUADCCWRTIWANL-UHFFFAOYSA-N
Formula
C16H12O5
SMILES
COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1
Molecular Weight1
284.26
CAS
491-80-5
Other Names
  • 4H-1-Benzopyran-4-one, 5,7-dihydroxy-3-(4-methoxyphenyl)-
  • Biochanin
  • Biochanin A
  • Biochanine A
  • Genistein 4-methyl ether
  • Isoflavone, 5,7-dihydroxy-4'-methoxy-
  • 4'-Methylgenistein
  • 5,7-Dihydroxy-4'-methoxyisoflavone
  • 5,7-dihydroxy-3-p-methoxyphenyl-4H-chromen-4-one
  • 5,7-Dihydroxy-3-(4-methoxyphenyl)-4H-chromen-4-one
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
log10WS -4.63 Relay (1.0) Calculated Property
logPoct/wat 2.880 Crippen Calculated Property
McVol 198.670 ml/mol McGowan Calculated Property
Inp [2927.10; 2927.10]   Show Hide
Inp 2927.10 NIST
Inp 2927.10 NIST
Tfus 530.01 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

5,7-dihydroxy-3-(4-hydroxyphenyl)-4H-chromen-4-one. 4H-1-Benzopyran-4-one, 7-hydroxy-3-(4-methoxyphenyl)-. daidzein. Daidzein, TMS. 4H-1-Benzopyran-4-one, 5-hydroxy-7-methoxy-2-(4-methoxyphenyl)-. Pectolinaringenin. 4H-1-Benzopyran-4-one, 5-hydroxy-2-(4-hydroxyphenyl)-6,7-dimethoxy-. 4H-1-Benzopyran-4-one, 5-hydroxy-6,7-dimethoxy-2-(4-methoxyphenyl)-. 4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxyphenyl)-6-methoxy-. 4H-1-Benzopyran-4-one, 5-hydroxy-7-methoxy-2-phenyl-. Jaceosidin. 2-(3,4-Dimethoxyphenyl)-5-hydroxy-6,7,8-trimethoxy-4H-chromen-4-one. CIRSILINEOL (5,4'-DIHYDROXY-6,7,3'-TRIMETHOXYFLAVONE). Isorhamnetin (4TMS). 4H-1-Benzopyran-4-one, 5-hydroxy-2-(4-hydroxyphenyl)-3,7-dimethoxy-.

Find more compounds similar to 4'-Methoxy-5,7-dihydroxy isoflavone.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.