Sesquiterpene, Stearic acid ester
[CAS# 52898-98-3]

Identification

• Name: Sesquiterpene, Stearic acid ester
• Synonyms: (7-Isopropenyl-4-Methyl-6,7-Dihydroazulen-1-Yl)Methyl Octadecanoate; Octadecanoic Acid (7-Isopropenyl-4-Methyl-6,7-Dihydroazulen-1-Yl)Methyl Ester; Stearic Acid (7-Isopropenyl-4-Methyl-6,7-Dihydroazulen-1-Yl)Methyl Ester
• Molecular Formula: C₃₃H₅₂O₂
• Molecular Weight: 480.77
• CAS Registry Number: 52898-98-3
• SMILES: C(C1=CC=C2C1=CC(C(=C)C)CC=C2C)OC(=O)CCCCCCCCCCCCCCCCC
• InChI: 1S/C33H52O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-33(34)35-26-30-23-24-31-28(4)21-22-29(27(2)3)25-32(30)31/h21,23-25,29H,2,5-20,22,26H2,1,3-4H3
• InChIKey: JJOMKEHSADWVHT-UHFFFAOYSA-N

Properties

• Density: 0.959g/cm³ (Cal.)
• Boiling point: 595.702°C at 760 mmHg (Cal.)
• Flash point: 110.888°C (Cal.)