Ingenane hexadecanoate
[CAS# 37394-33-5]

Identification

• Name: Ingenane hexadecanoate
• Synonyms: Ingenane Hexadecanoate
• Molecular Formula: C₃₆H₅₈O₆
• Molecular Weight: 586.85
• CAS Registry Number: 37394-33-5
• SMILES: [C@H]12[C@H](C1(C)C)C[C@@H](C34C(=O)[C@@H]2C=C([C@H](OC(=O)CCCCCCCCCCCCCCC)[C@@]3(O)[C@H](O)C(=C4)C)CO)C
• InChI: 1S/C36H58O6/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-29(38)42-33-26(23-37)21-27-30-28(34(30,4)5)20-25(3)35(32(27)40)22-24(2)31(39)36(33,35)41/h21-22,25,27-28,30-31,33,37,39,41H,6-20,23H2,1-5H3/t25-,27+,28+,30-,31+,33-,35?,36-/m0/s1
• InChIKey: FERBCNQIQRZHHD-OVTXEERBSA-N

Properties

• Density: 1.122g/cm³ (Cal.)
• Boiling point: 670.463°C at 760 mmHg (Cal.)
• Flash point: 198.9°C (Cal.)