69097-99-0

Name (2S)-5,7-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-chromanone, 3',5,7-Trihydroxy-4-methoxyflavanone
CAS 69097-99-0
Molecular Formula C16H14O6
MDL Number MFCD00016956
Molecular Weight 302.28
MOL File 69097-99-0.mol
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Chemical Properties

Melting point  227-232°C
Boiling point  586.2±50.0 °C(Predicted)
density  1.458±0.06 g/cm3(Predicted)
FEMA  4313 | 5,7-DIHYDROXY-2-(3-HYDROXY-4-METHOXYPHENYL)CHROMAN-4-ONE
storage temp.  2-8°C
solubility  ethanol: soluble50mg/mL, clear to almost clear, colorless to slightly yellow
form  powder (with a light tan cast)
pka 7.49±0.40(Predicted)
color  Pale Yellow to Light Brown
biological source synthetic
JECFA Number 2024
Major Application flavors and fragrances
InChI 1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3
InChIKey AIONOLUJZLIMTK-UHFFFAOYSA-N
SMILES COc1ccc(cc1O)C2CC(=O)c3c(O)cc(O)cc3O2
LogP 1.938 (est)

Safety Data

WGK Germany  2
HS Code  2932990090
Storage Class 11 - Combustible Solids

Hazard Information

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