Methyl 4-[(2R)-3-[(1E,3E,5E,8E)-Tetradeca-1,3,5,8-Tetraenyl]Oxiran-2-Yl]Butanoate
[CAS# 75879-18-4]

Identification

• Name: Methyl 4-[(2R)-3-[(1E,3E,5E,8E)-Tetradeca-1,3,5,8-Tetraenyl]Oxiran-2-Yl]Butanoate
• Synonyms: 4-[(2R)-3-[(1E,3E,5E,8E)-Tetradeca-1,3,5,8-Tetraenyl]-2-Oxiranyl]Butanoic Acid Methyl Ester; 4-[(2R)-3-[(1E,3E,5E,8E)-Tetradeca-1,3,5,8-Tetraenyl]Oxiran-2-Yl]Butyric Acid Methyl Ester; Leukotriene A Methyl Ester
• Molecular Formula: C₂₁H₃₂O₃
• Molecular Weight: 332.48
• CAS Registry Number: 75879-18-4
• SMILES: [C@@H]1(OC1\C=C\C=C\C=C\C\C=C\CCCCC)CCCC(OC)=O
• InChI: 1S/C21H32O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-16-19-20(24-19)17-15-18-21(22)23-2/h7-8,10-14,16,19-20H,3-6,9,15,17-18H2,1-2H3/b8-7+,11-10+,13-12+,16-14+/t19?,20-/m1/s1
• InChIKey: WTKAVFHPLJFCMZ-WUHFFIFTSA-N

Properties

• Density: 0.998g/cm³ (Cal.)
• Boiling point: 442.453°C at 760 mmHg (Cal.)
• Flash point: 167.726°C (Cal.)