8a-Hydroperoxy-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-one
[CAS# 67353-73-5]

Identification

• Name: 8a-Hydroperoxy-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-one
• Synonyms: 2H-1-Benzopyran-6(8Ah)-One, 3,4-Dihydro-8A-Hydroperoxy-2,5,7,8-Tetramethyl-2-(4,8,12-Trimethyltridecyl)-; 8-Hydroperoxytocopherone
• Molecular Formula: C₂₉H₅₀O₄
• Molecular Weight: 462.71
• CAS Registry Number: 67353-73-5
• SMILES: C(C2(OC1(OO)C(=C(C(=O)C(=C1C)C)C)CC2)C)CCC(CCCC(CCCC(C)C)C)C
• InChI: 1S/C29H50O4/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-28(8)19-17-26-24(6)27(30)23(5)25(7)29(26,32-28)33-31/h20-22,31H,9-19H2,1-8H3
• InChIKey: RRXJPOVHZKUNOV-UHFFFAOYSA-N

Properties

• Density: 1.005g/cm³ (Cal.)
• Boiling point: 563.409°C at 760 mmHg (Cal.)
• Flash point: 171.767°C (Cal.)