1-[(3S,3aS,5aR,7R,9aR,9bS)-7-(2-Hydroxyethyl)-3a-Methyl-1,2,3,4,5,5a,6,7,8,9,9a,9b-Dodecahydrocyclopenta[h]Naphthalen-3-Yl]Ethanone
[CAS# 145551-68-4]

Identification

• Name: 1-[(3S,3aS,5aR,7R,9aR,9bS)-7-(2-Hydroxyethyl)-3a-Methyl-1,2,3,4,5,5a,6,7,8,9,9a,9b-Dodecahydrocyclopenta[h]Naphthalen-3-Yl]Ethanone
• Synonyms: 1-(7-(2-Hydroxyethyl)Dodecahydro-3A-Methyl-1H-Benz(E)Inden-3-Yl)Ethanone; 3S-(3Alpha,3Aalpha,5Abeta,7Alpha,9Aalpha,9Bbeta)-1-(7-(2-Hydroxyethyl)Dodecahydro-3A-Methyl-1H-Benz(E)Inden-3-Yl)Ethanone; Bi-1
• Molecular Formula: C₁₈H₃₀O₂
• Molecular Weight: 278.43
• CAS Registry Number: 145551-68-4
• SMILES: [C@H]12[C@H]3[C@H](CC[C@@]1([C@H](CC2)C(=O)C)C)C[C@@H](CC3)CCO
• InChI: 1S/C18H30O2/c1-12(20)16-5-6-17-15-4-3-13(8-10-19)11-14(15)7-9-18(16,17)2/h13-17,19H,3-11H2,1-2H3/t13-,14+,15+,16+,17-,18+/m0/s1
• InChIKey: OOTXTVKIKCULJJ-UIGZQWRCSA-N

Properties

• Density: 1.017g/cm³ (Cal.)
• Boiling point: 396.022°C at 760 mmHg (Cal.)
• Flash point: 169.118°C (Cal.)