(-)-Oppositol
[CAS# 50906-52-0]

Identification

• Name: (-)-Oppositol
• Synonyms: 1H-Inden-4-Ol, 7-Bromooctahydro-4,7A-Dimethyl-3-(2-Methyl-1-Propenyl)-, (3S-(3Alpha,3Aalpha,4Beta,7Beta,7Abeta))-; Oppositol
• Molecular Formula: C₁₅H₂₅BrO
• Molecular Weight: 301.27
• CAS Registry Number: 50906-52-0
• SMILES: [C@]12([C@H]([C@H](C=C(C)C)CC1)[C@@](O)(C)CC[C@@H]2Br)C
• InChI: 1S/C15H25BrO/c1-10(2)9-11-5-7-14(3)12(16)6-8-15(4,17)13(11)14/h9,11-13,17H,5-8H2,1-4H3/t11-,12-,13-,14+,15+/m0/s1
• InChIKey: NEJWBGSUEYGAGE-BTFPBAQTSA-N

Properties

• Density: 1.269g/cm³ (Cal.)
• Boiling point: 343.96°C at 760 mmHg (Cal.)
• Flash point: 161.821°C (Cal.)