(1S-(1alpha(1R*,4R*),3abeta,4beta,7beta,7aalpha))-1-((1-(acetyloxy)-4-bromo-3,3-dimethylcyclohexyl)methyl)-4-bromooctahydro-7-methyl-7,3a-(Epoxymethano)-3aH-inden-9-one
[CAS# 123967-75-9]

Identification

• Name: (1S-(1alpha(1R*,4R*),3abeta,4beta,7beta,7aalpha))-1-((1-(acetyloxy)-4-bromo-3,3-dimethylcyclohexyl)methyl)-4-bromooctahydro-7-methyl-7,3a-(Epoxymethano)-3aH-inden-9-one
• Synonyms: Angasiol Acetate
• Molecular Formula: C₂₂H₃₂Br₂O₄
• Molecular Weight: 520.30
• CAS Registry Number: 123967-75-9
• SMILES: C(C2C1C3(CCC(C1(CC2)C(=O)O3)Br)C)C4(CCC(C(C4)(C)C)Br)OC(C)=O
• InChI: 1S/C22H32Br2O4/c1-13(25)27-21(9-7-15(23)19(2,3)12-21)11-14-5-10-22-16(24)6-8-20(4,17(14)22)28-18(22)26/h14-17H,5-12H2,1-4H3
• InChIKey: SJYSXOUMHQMJSR-UHFFFAOYSA-N

Properties

• Density: 1.481g/cm³ (Cal.)
• Boiling point: 547.421°C at 760 mmHg (Cal.)
• Flash point: 284.87°C (Cal.)