alpha-Tocopherol linoleate
[CAS# 51744-92-4]

Identification

• Name: alpha-Tocopherol linoleate
• Synonyms: (9Z,12Z)-Octadeca-9,12-Dienoic Acid [(2R)-2,5,7,8-Tetramethyl-2-[(4R,8R)-4,8,12-Trimethyltridecyl]-6-Chromanyl] Ester; (9Z,12Z)-Octadeca-9,12-Dienoic Acid [(2R)-2,5,7,8-Tetramethyl-2-[(4R,8R)-4,8,12-Trimethyltridecyl]Chroman-6-Yl] Ester
• Molecular Formula: C₄₇H₈₀O₃
• Molecular Weight: 693.15
• CAS Registry Number: 51744-92-4
• SMILES: [C@]2(OC1=C(C(=C(OC(=O)CCCCCCC\C=C/C/C=C\CCCCC)C(=C1CC2)C)C)C)(CCC[C@@H](CCC[C@@H](CCCC(C)C)C)C)C
• InChI: 1S/C47H80O3/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-33-44(48)49-45-40(6)41(7)46-43(42(45)8)34-36-47(9,50-46)35-27-32-39(5)31-26-30-38(4)29-25-28-37(2)3/h14-15,17-18,37-39H,10-13,16,19-36H2,1-9H3/b15-14-,18-17-/t38-,39-,47-/m1/s1
• InChIKey: OFUHPGMOWVHNPN-QWZFGMNQSA-N

Properties

• Density: 0.92g/cm³ (Cal.)
• Boiling point: 721.133°C at 760 mmHg (Cal.)
• Flash point: 320.847°C (Cal.)