2-Carbamoyl-5,5-dimethyl-1,4-hexanedione
[CAS# 941-70-8]

Identification

• Name: 2-Carbamoyl-5,5-dimethyl-1,4-hexanedione
• Synonyms: 4,4-Dimethyl-2,6-Dioxo-Cyclohexane-1-Carboxamide; 4,4-Dimethyl-2,6-Dioxo-1-Cyclohexanecarboxamide; 2,6-Diketo-4,4-Dimethyl-Cyclohexane-1-Carboxamide
• Molecular Formula: C₉H₁₃NO₃
• Molecular Weight: 183.21
• CAS Registry Number: 941-70-8
• SMILES: CC1(CC(C(C(C1)=O)C(N)=O)=O)C
• InChI: 1S/C9H13NO3/c1-9(2)3-5(11)7(8(10)13)6(12)4-9/h7H,3-4H2,1-2H3,(H2,10,13)
• InChIKey: CXYHFBSJWRHKML-UHFFFAOYSA-N

Properties

• Density: 1.172g/cm³ (Cal.)
• Boiling point: 411.111°C at 760 mmHg (Cal.)
• Flash point: 202.433°C (Cal.)