(4alpha-Formyl-8-Hydroxy-1,1-Dimethyl-5,6-Dioxo-7-Propan-2-Yl-2,3,4,9,10,10alpha-Hexahydrophenanthren-9-Yl) Acetate
[CAS# 32764-46-8]

Identification

• Name: (4alpha-Formyl-8-Hydroxy-1,1-Dimethyl-5,6-Dioxo-7-Propan-2-Yl-2,3,4,9,10,10alpha-Hexahydrophenanthren-9-Yl) Acetate
• Synonyms: (4A-Formyl-8-Hydroxy-7-Isopropyl-1,1-Dimethyl-5,6-Dioxo-2,3,4,9,10,10A-Hexahydrophenanthren-9-Yl) Acetate; Acetic Acid (4A-Formyl-8-Hydroxy-7-Isopropyl-1,1-Dimethyl-5,6-Dioxo-2,3,4,9,10,10A-Hexahydrophenanthren-9-Yl) Ester; Acetic Acid (4A-Formyl-8-Hydroxy-7-Isopropyl-5,6-Diketo-1,1-Dimethyl-2,3,4,9,10,10A-Hexahydrophenanthren-9-Yl) Ester
• Molecular Formula: C₂₂H₂₈O₆
• Molecular Weight: 388.46
• CAS Registry Number: 32764-46-8
• SMILES: CC1(C2C(CCC1)(C3=C(C(OC(=O)C)C2)C(=C(C(=O)C3=O)C(C)C)O)C=O)C
• InChI: 1S/C22H28O6/c1-11(2)15-18(25)16-13(28-12(3)24)9-14-21(4,5)7-6-8-22(14,10-23)17(16)20(27)19(15)26/h10-11,13-14,25H,6-9H2,1-5H3
• InChIKey: QUZUXFUSBGXSIW-UHFFFAOYSA-N

Properties

• Density: 1.239g/cm³ (Cal.)
• Boiling point: 500.251°C at 760 mmHg (Cal.)
• Flash point: 167.533°C (Cal.)