Di-(3beta)-Cholest-5-En-3-Yl Sebacate
[CAS# 23394-16-3]

Identification

• Name: Di-(3beta)-Cholest-5-En-3-Yl Sebacate
• Synonyms: bis[cholest-5-en-3β-yl] sebacate
• Molecular Formula: C₆₄H₁₀₆O₄
• Molecular Weight: 939.52
• CAS Registry Number: 23394-16-3
• EINECS: 245-633-5
• SMILES: CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)CCCCCCCCC(=O)O[C@H]6CC[C@]7(C)[C@H]8CC[C@@]5(C)[C@@H](CC[C@@H]5[C@H](C)CCCC(C)C)[C@@H]8CC=C7C6
• InChI: 1S/C64H106O4/c1-43(2)19-17-21-45(5)53-29-31-55-51-27-25-47-41-49(33-37-61(47,7)57(51)35-39-63(53,55)9)67-59(65)23-15-13-11-12-14-16-24-60(66)68-50-34-38-62(8)48(42-50)26-28-52-56-32-30-54(46(6)22-18-20-44(3)4)64(56,10)40-36-58(52)62/h25-26,43-46,49-58H,11-24,27-42H2,1-10H3/t45-,46-,49+,50+,51+,52+,53-,54-,55+,56+,57+,58+,61+,62+,63-,64-/m1/s1
• InChIKey: WUHFQANUEHARLW-VXOVUZAMSA-N

Properties

• Density: 1.026g/cm³ (Cal.)
• Boiling point: 837.779°C at 760 mmHg (Cal.)
• Flash point: 399.751°C (Cal.)
• Refractive index: 1.534 (Cal.)