3,4-Dihydro-3,6,9-Trihydroxy-7-Methoxy-3-Methyl-1H-Naphtho[2,3-c]Pyran-5,10-Dione
[CAS# 1702-77-8]

Identification

• Name: 3,4-Dihydro-3,6,9-Trihydroxy-7-Methoxy-3-Methyl-1H-Naphtho[2,3-c]Pyran-5,10-Dione
• Synonyms: 3,5,10-Trihydroxy-7-Methoxy-3-Methyl-1,4-Dihydrobenzo[G]Isochromene-6,9-Quinone; Nci60_000144; 1,4-Naphthoquinone, 3-Acetonyl-5,8-Dihydroxy-2-(Hydroxymethyl)-6-Methoxy- (8Ci)
• Molecular Formula: C₁₅H₁₄O₇
• Molecular Weight: 306.27
• CAS Registry Number: 1702-77-8
• SMILES: CC1(OCC2=C(C1)C(=C3C(=C2O)C(=O)C=C(OC)C3=O)O)O
• InChI: 1S/C15H14O7/c1-15(20)4-6-7(5-22-15)13(18)10-8(16)3-9(21-2)14(19)11(10)12(6)17/h3,17-18,20H,4-5H2,1-2H3
• InChIKey: FKJXMYJPOKQPSS-UHFFFAOYSA-N

Properties

• Density: 1.6±0.1g/cm³ (Cal.)
• Boiling point: 663.7±55.0°C at 760 mmHg (Cal.)
• Flash point: 254.0±25.0°C (Cal.)