3,4-Dihydro-2,7,8-Trimethyl-2-(4,8,12-Trimethyltridecyl)-2H-Benzopyran-6-Ol
[CAS 7616-22-0]

Identification

• Name: 3,4-Dihydro-2,7,8-Trimethyl-2-(4,8,12-Trimethyltridecyl)-2H-Benzopyran-6-Ol
• Synonyms: 2,7,8-Trimethyl-2-(4,8,12-Trimethyltridecyl)-6-Chromanol; Ls-826; 2H-1-Benzopyran-6-Ol, 3,4-Dihydro-2,7,8-Trimethyl-2-(4,8,12-Trimethyltridecyl)-
• Molecular Formula: C₂₈H₄₈O₂
• Molecular Weight: 416.69
• CAS Registry Number: 7616-22-0 (1406-66-2)
• EINECS: 231-523-4
• SMILES: C1=C(O)C(=C(C2=C1CCC(O2)(CCCC(CCCC(CCCC(C)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)18-16-25-19-26(29)23(5)24(6)27(25)30-28/h19-22,29H,8-18H2,1-7H3
• InChIKey: QUEDXNHFTDJVIY-UHFFFAOYSA-N

Properties

• Density: 0.933g/cm³ (Cal.)
• Boiling point: 518.111°C at 760 mmHg (Cal.)
• Flash point: 205.982°C (Cal.)

References

• (1): Abul K. Mallik, Hongdeng Qiu, Makoto Takafuji and Hirotaka Ihara. Strategic achievement for the baseline separation of tocopherol isomers by integration of weak interaction sites on alternating copolymer, Anal. Methods, 2011, 3, 1277.