(1aS,4S,4aS,5aR,5bS,8aR,8bS)-5a,7,7-Trimethyloctahydrocyclopropa[4,5]oxireno[6,7]indeno[5,6-c]furan-4-yl stearate
[CAS# 86562-14-3]

Identification

• Name: (1aS,4S,4aS,5aR,5bS,8aR,8bS)-5a,7,7-Trimethyloctahydrocyclopropa[4,5]oxireno[6,7]indeno[5,6-c]furan-4-yl stearate
• Synonyms: Octadecanoic acid, octahydro-5a,7,7-trimethyl-2H,4H-cycloprop(4,5)oxireno(6,7)indeno(5,6-c)furan-4-yl ester, (4S-(1aR*,4α,4aR*,5aβ,5bα,8aα,8bβ))-; Stearoylvelutinal
• Molecular Formula: C₃₃H₅₆O₄
• Molecular Weight: 516.80
• CAS Registry Number: 86562-14-3
• SMILES: O=C(O[C@@H]3OC[C@@]15O[C@H]5[C@H]4[C@@H]([C@@]2([C@@]13C2)C)CC(C)(C)C4)CCCCCCCCCCCCCCCCC
• InChI: 1S/C33H56O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-27(34)36-29-32-23-31(32,4)26-22-30(2,3)21-25(26)28-33(32,37-28)24-35-29/h25-26,28-29H,5-24H2,1-4H3/t25-,26+,28+,29+,31-,32+,33+/m1/s1
• InChIKey: VRKPUGRREPONNX-FUKPGCDFSA-N

Properties

• Density: 1.049g/cm³ (Cal.)
• Boiling point: 575.645°C at 760 mmHg (Cal.)
• Flash point: 237.202°C (Cal.)