Tri-O-thymotide
[CAS# 4399-52-4]

Identification

• Name: Tri-O-thymotide
• Synonyms: ZINC02149568
• Molecular Formula: C₃₃H₃₆O₆
• Molecular Weight: 528.64
• CAS Registry Number: 4399-52-4
• SMILES: O=C2Oc4c(C(=O)Oc3c(C(=O)Oc1c(ccc(c12)C)C(C)C)c(ccc3C(C)C)C)c(ccc4C(C)C)C
• InChI: 1S/C33H36O6/c1-16(2)22-13-10-19(7)25-28(22)37-32(35)26-20(8)11-14-23(17(3)4)29(26)39-33(36)27-21(9)12-15-24(18(5)6)30(27)38-31(25)34/h10-18H,1-9H3
• InChIKey: ZIKHLMVJGCYVAC-UHFFFAOYSA-N

Properties

• Density: 1.139g/cm³ (Cal.)
• Boiling point: 658.94°C at 760 mmHg (Cal.)
• Flash point: 275.177°C (Cal.)