3,6,9-Trihydroxypterocarpan
[CAS# 69393-95-9]

Identification

• Name: 3,6,9-Trihydroxypterocarpan
• Synonyms: (6As,11As)-6,11A-Dihydrobenzofurano[3,2-C]Chromene-3,6A,9-Triol; (6As,11As)-3,6A,9-Trihydroxypterocarpan; 3,6,9-Trihydroxypterocarpan
• Molecular Formula: C₁₅H₁₂O₅
• Molecular Weight: 272.26
• CAS Registry Number: 69393-95-9
• SMILES: [C@]13([C@@H](OC2=CC(=CC=C12)O)C4=C(OC3)C=C(O)C=C4)O
• InChI: 1S/C15H12O5/c16-8-1-3-10-12(5-8)19-7-15(18)11-4-2-9(17)6-13(11)20-14(10)15/h1-6,14,16-18H,7H2/t14-,15+/m0/s1
• InChIKey: QMXOFBXZEKTJIK-LSDHHAIUSA-N

Properties

• Density: 1.592g/cm³ (Cal.)
• Boiling point: 526.971°C at 760 mmHg (Cal.)
• Flash point: 272.502°C (Cal.)

References

• (1): Luniwal Amarjit, Khupse Rahul S., Reese Michael, Fang Lei, Erhardt Paul W.. Total Syntheses of Racemic and Natural Glycinol, Journal of Natural Products, 2009