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34086-50-5

Name alpinumisoflavone
CAS 34086-50-5
Molecular Formula C20H16O5
MDL Number MFCD02183440
Molecular Weight 336.34
MOL File 34086-50-5.mol
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Chemical Properties

Melting point  213 °C(Solv: acetonitrile (75-05-8))
Boiling point  562.1±50.0 °C(Predicted)
density  1.368±0.06 g/cm3(Predicted)
form  Solid
pka 6.28±0.40(Predicted)
color  Off-white to light yellow
InChI InChI=1S/C20H16O5/c1-20(2)8-7-13-15(25-20)9-16-17(18(13)22)19(23)14(10-24-16)11-3-5-12(21)6-4-11/h3-10,21-22H,1-2H3
InChIKey RQAMSFTXEFSBPK-UHFFFAOYSA-N
SMILES C12=CC3OC=C(C4=CC=C(O)C=C4)C(=O)C=3C(O)=C1C=CC(C)(C)O2

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