2,3,5-Trimethyl-6-[2-(2-Methyl-5-Oxooxolan-2-Yl)Ethyl]Cyclohexa-2,5-Diene-1,4-Dione
[CAS# 3121-68-4]

Identification

• Name: 2,3,5-Trimethyl-6-[2-(2-Methyl-5-Oxooxolan-2-Yl)Ethyl]Cyclohexa-2,5-Diene-1,4-Dione
• Synonyms: 2,3,5-Trimethyl-6-[2-(2-Methyl-5-Oxo-Tetrahydrofuran-2-Yl)Ethyl]-1,4-Benzoquinone; 2,3,5-Trimethyl-6-[2-(2-Methyl-5-Oxo-2-Tetrahydrofuranyl)Ethyl]-1,4-Benzoquinone; 2-[2-(5-Keto-2-Methyl-Tetrahydrofuran-2-Yl)Ethyl]-3,5,6-Trimethyl-P-Benzoquinone
• Molecular Formula: C₁₆H₂₀O₄
• Molecular Weight: 276.33
• CAS Registry Number: 3121-68-4
• SMILES: C(C1=C(C(C(=C(C1=O)C)C)=O)C)CC2(OC(CC2)=O)C
• InChI: 1S/C16H20O4/c1-9-10(2)15(19)12(11(3)14(9)18)5-7-16(4)8-6-13(17)20-16/h5-8H2,1-4H3
• InChIKey: XTCLGZZKAQZZJC-UHFFFAOYSA-N

Properties

• Density: 1.122g/cm³ (Cal.)
• Boiling point: 423.143°C at 760 mmHg (Cal.)
• Flash point: 187.127°C (Cal.)