5-Cholesten-3beta-Ol 3-(2'-Ethylhexylcarbonate)
[CAS# 61922-29-0]

Identification

• Name: 5-Cholesten-3beta-Ol 3-(2'-Ethylhexylcarbonate)
• Synonyms: [(3S,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-Dimethylhexyl]-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] 2-Ethylhexyl Carbonate; Carbonic Acid [(3S,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-Dimethylhexyl]-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] 2-Ethylhexyl Ester; Cholest-5-En-3-Ol (3Beta)-, 2-Ethylhexyl Carbonate
• Molecular Formula: C₃₆H₆₂O₃
• Molecular Weight: 542.88
• CAS Registry Number: 61922-29-0
• EINECS: 263-323-8
• SMILES: [C@H]34[C@H]1[C@@H]([C@@]2(C(=CC1)C[C@@H](OC(OCC(CCCC)CC)=O)CC2)C)CC[C@@]3([C@H](CC4)[C@@H](CCCC(C)C)C)C
• InChI: 1S/C36H62O3/c1-8-10-14-27(9-2)24-38-34(37)39-29-19-21-35(6)28(23-29)15-16-30-32-18-17-31(26(5)13-11-12-25(3)4)36(32,7)22-20-33(30)35/h15,25-27,29-33H,8-14,16-24H2,1-7H3/t26-,27?,29+,30+,31-,32+,33+,35+,36-/m1/s1
• InChIKey: VVOYNPVJLBAMPC-MSRDKCBUSA-N

Properties

• Density: 0.99g/cm³ (Cal.)
• Boiling point: 602.827°C at 760 mmHg (Cal.)
• Flash point: 143.179°C (Cal.)