Propane-1,2-diyl Diacetoacetate
[CAS# 6079-90-9]

Identification

• Name: Propane-1,2-diyl Diacetoacetate
• Synonyms: [1-Methyl-2-(3-Oxobutanoyloxy)Ethyl] 3-Oxobutanoate; 3-Oxobutanoic Acid [2-(1,3-Dioxobutoxy)-1-Methylethyl] Ester; 3-Ketobutyric Acid (2-Acetoacetyloxy-1-Methyl-Ethyl) Ester
• Molecular Formula: C₁₁H₁₆O₆
• Molecular Weight: 244.24
• CAS Registry Number: 6079-90-9
• EINECS: 228-017-0
• SMILES: C(C(=O)OC(COC(CC(=O)C)=O)C)C(=O)C
• InChI: 1S/C11H16O6/c1-7(12)4-10(14)16-6-9(3)17-11(15)5-8(2)13/h9H,4-6H2,1-3H3
• InChIKey: LJJMDCNKKJRLBW-UHFFFAOYSA-N

Properties

• Density: 1.154g/cm³ (Cal.)
• Boiling point: 340.771°C at 760 mmHg (Cal.)
• Flash point: 148.861°C (Cal.)