5-Hydroxy-3,6-dimethoxy-2-methyl-1,4-naphthoquinone | CAS No. 1447016-25-2

5-Hydroxy-3,6-dimethoxy-2-methyl-1,4-naphthoquinone

Basic Information

CAS Number

1447016-25-2

Molecular Formula

C13H12O5

Molecular Weight

248.23 g/mol

AD

Basic Physical Properties

Boiling Point

469.4±45.0 °C(Predicted)

Density

1.36±0.1 g/cm3(Predicted)

COC1=C(C)C(=O)c2ccc(OC)c(O)c2C1=O

InChI

InChI=1S/C13H12O5/c1-6-10(14)7-4-5-8(17-2)11(15)9(7)12(16)13(6)18-3/h4-5,15H,1-3H3

InChIKey

WBIIXLONAPDMOO-UHFFFAOYSA-N

LogP

1.7002

pKa

6.47±0.20(Predicted)

Topological Polar Surface Area

72.83000000000001 Ų

Hydrogen Bond Donor/Acceptor

1 / 5

Synonyms & References

English

  • 5-Hydroxy-3,6-dimethoxy-2-methyl-1,4-naphthoquinone
  • 1,4-Naphthalenedione, 5-hydroxy-3,6-dimethoxy-2-methyl-

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