3,4-Dihydroxy-5-(3-Methylbutyl)-2-(3-Methyl-1-Oxobutyl)-4-(4-Methyl-1-Oxopentyl)Cyclopent-2-En-1-One
[CAS# 22748-57-8]

Identification

• Name: 3,4-Dihydroxy-5-(3-Methylbutyl)-2-(3-Methyl-1-Oxobutyl)-4-(4-Methyl-1-Oxopentyl)Cyclopent-2-En-1-One
• Synonyms: 3,4-Dihydroxy-5-Isopentyl-2-(3-Methylbutanoyl)-4-(4-Methylpentanoyl)Cyclopent-2-En-1-One; 3,4-Dihydroxy-5-Isopentyl-2-(3-Methyl-1-Oxobutyl)-4-(4-Methyl-1-Oxopentyl)-1-Cyclopent-2-Enone; 3,4-Dihydroxy-5-Isoamyl-2-Isovaleryl-4-(4-Methylpentanoyl)Cyclopent-2-En-1-One
• Molecular Formula: C₂₁H₃₄O₅
• Molecular Weight: 366.50
• CAS Registry Number: 22748-57-8
• EINECS: 245-193-4
• SMILES: C(C1C(C(=C(C1=O)C(CC(C)C)=O)O)(C(=O)CCC(C)C)O)CC(C)C
• InChI: 1S/C21H34O5/c1-12(2)7-9-15-19(24)18(16(22)11-14(5)6)20(25)21(15,26)17(23)10-8-13(3)4/h12-15,25-26H,7-11H2,1-6H3
• InChIKey: JIZQRWKUYFNSDM-UHFFFAOYSA-N

Properties

• Density: 1.1g/cm³ (Cal.)
• Boiling point: 515.489°C at 760 mmHg (Cal.)
• Flash point: 279.643°C (Cal.)