12alpha-Hydroxyrotenone
[CAS# 509-96-6]

Identification

• Name: 12alpha-Hydroxyrotenone
• Synonyms: 6A-Beta,12A-Beta-Rotenolone; Rotenalone; Rotenolone
• Molecular Formula: C₂₃H₂₂O₇
• Molecular Weight: 410.42
• CAS Registry Number: 509-96-6
• SMILES: [C@@]23(C1=C(C=C(C(=C1)OC)OC)OC[C@H]2OC4=C(C3=O)C=CC5=C4C[C@H](C(=C)C)O5)O
• InChI: 1S/C23H22O7/c1-11(2)16-7-13-15(29-16)6-5-12-21(13)30-20-10-28-17-9-19(27-4)18(26-3)8-14(17)23(20,25)22(12)24/h5-6,8-9,16,20,25H,1,7,10H2,2-4H3/t16-,20-,23-/m1/s1
• InChIKey: JFVKWCYZKMUTLH-AYPBNUJASA-N

Properties

• Density: 1.359g/cm³ (Cal.)
• Boiling point: 623.062°C at 760 mmHg (Cal.)
• Flash point: 219.155°C (Cal.)