(5Z,7E)-9,10-Secostigmasta-5,7,10(19)-Trien-3beta-Ol
[CAS# 71761-06-3]

Identification

• Name: (5Z,7E)-9,10-Secostigmasta-5,7,10(19)-Trien-3beta-Ol
• Synonyms: (1R,3Z)-3-[(2E)-2-[(1R,3As,7Ar)-1-[(1R,4R)-4-Ethyl-1,5-Dimethyl-Hexyl]-7A-Methyl-2,3,3A,5,6,7-Hexahydro-1H-Inden-4-Ylidene]Ethylidene]-4-Methylene-Cyclohexan-1-Ol; (1R,3Z)-3-[(2E)-2-[(1R,3As,7Ar)-1-[(1R,4R)-4-Ethyl-1,5-Dimethylhexyl]-7A-Methyl-2,3,3A,5,6,7-Hexahydro-1H-Inden-4-Ylidene]Ethylidene]-4-Methylene-1-Cyclohexanol; (1R,3Z)-3-[(2E)-2-[(1R,3As,7Ar)-1-[(2R,5R)-5-Ethyl-6-Methyl-Heptan-2-Yl]-7A-Methyl-2,3,3A,5,6,7-Hexahydro-1H-Inden-4-Ylidene]Ethylidene]-4-Methylidene-Cyclohexan-1-Ol
• Molecular Formula: C₂₉H₄₈O
• Molecular Weight: 412.70
• CAS Registry Number: 71761-06-3
• SMILES: [C@]13([C@H](\C(CCC1)=C\C=C\2C(CC[C@@H](O)C2)=C)CC[C@@H]3[C@@H](CC[C@H](C(C)C)CC)C)C
• InChI: 1S/C29H48O/c1-7-23(20(2)3)12-10-22(5)27-16-17-28-24(9-8-18-29(27,28)6)13-14-25-19-26(30)15-11-21(25)4/h13-14,20,22-23,26-28,30H,4,7-12,15-19H2,1-3,5-6H3/b24-13+,25-14-/t22-,23-,26-,27-,28+,29-/m1/s1
• InChIKey: RMDJVOZETBHEAR-AQYWQOAJSA-N

Properties

• Density: 0.96g/cm³ (Cal.)
• Boiling point: 516.985°C at 760 mmHg (Cal.)
• Flash point: 225.084°C (Cal.)