[2R[2R*(4R*,8R*)]]-3,4-Dihydro-2,5,8-Trimethyl-2-(4,8,12-Trimethyltridecyl)-2H-Benzopyran-6-Ol
[CAS# 16698-35-4]

Identification

• Name: [2R[2R*(4R*,8R*)]]-3,4-Dihydro-2,5,8-Trimethyl-2-(4,8,12-Trimethyltridecyl)-2H-Benzopyran-6-Ol
• Synonyms: 2,5,8-Trimethyl-2-(4,8,12-Trimethyltridecyl)-6-Chromanol; Vitamin Ebeta; .Beta.-Tocopherol
• Molecular Formula: C₂₈H₄₈O₂
• Molecular Weight: 416.69
• CAS Registry Number: 16698-35-4
• EINECS: 240-747-1
• SMILES: C1=C(C2=C(C(=C1O)C)CCC(O2)(CCCC(CCCC(CCCC(C)C)C)C)C)C
• InChI: 1S/C28H48O2/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-17-28(7)18-16-25-24(6)26(29)19-23(5)27(25)30-28/h19-22,29H,8-18H2,1-7H3
• InChIKey: WGVKWNUPNGFDFJ-UHFFFAOYSA-N

Properties

• Density: 0.933g/cm³ (Cal.)
• Boiling point: 516.267°C at 760 mmHg (Cal.)
• Flash point: 204.683°C (Cal.)