6-[(2Z)-2-[7alpha-Methyl-1-(6-Methylheptan-2-Yl)-2,3,3A,5,6,7-Hexahydro-1H-Inden-4-Ylidene]Ethylidene]Cycloheptane-1,4-Diol
[CAS# 75946-87-1]

Identification

• Name: 6-[(2Z)-2-[7alpha-Methyl-1-(6-Methylheptan-2-Yl)-2,3,3A,5,6,7-Hexahydro-1H-Inden-4-Ylidene]Ethylidene]Cycloheptane-1,4-Diol
• Synonyms: 6-[(2Z)-2-[1-(1,5-Dimethylhexyl)-7A-Methyl-2,3,3A,5,6,7-Hexahydro-1H-Inden-4-Ylidene]Ethylidene]Cycloheptane-1,4-Diol; 1,4-Ddhns; 1,4-Dihydroxy-3-Deoxy-A-Homo-19-Nor-9,10-Secocholesta-4,7-Diene
• Molecular Formula: C₂₇H₄₆O₂
• Molecular Weight: 402.66
• CAS Registry Number: 75946-87-1
• SMILES: C(C(C3C1(C(C(/CCC1)=C\C=C2/CC(O)CCC(O)C2)CC3)C)C)CCC(C)C
• InChI: 1S/C27H46O2/c1-19(2)7-5-8-20(3)25-14-15-26-22(9-6-16-27(25,26)4)11-10-21-17-23(28)12-13-24(29)18-21/h10-11,19-20,23-26,28-29H,5-9,12-18H2,1-4H3/b21-10?,22-11-
• InChIKey: YMBNJMCCFCSRBU-ZPEIZEFESA-N

Properties

• Density: 1.055g/cm³ (Cal.)
• Boiling point: 531.127°C at 760 mmHg (Cal.)
• Flash point: 221.388°C (Cal.)