2,4,4-Trimethyl-6-Oxocyclohexanecarboxylic Acid Methyl Ester
[CAS# 54576-10-2]

Identification

• Name: 2,4,4-Trimethyl-6-Oxocyclohexanecarboxylic Acid Methyl Ester
• Synonyms: Methyl 2,4,4-Trimethyl-6-Oxo-Cyclohexane-1-Carboxylate; 2,4,4-Trimethyl-6-Oxo-1-Cyclohexanecarboxylic Acid Methyl Ester; 2-Keto-4,4,6-Trimethyl-Cyclohexane-1-Carboxylic Acid Methyl Ester
• Molecular Formula: C₁₁H₁₈O₃
• Molecular Weight: 198.26
• CAS Registry Number: 54576-10-2
• SMILES: CC1(CC(=O)C(C(C1)C)C(=O)OC)C
• InChI: 1S/C11H18O3/c1-7-5-11(2,3)6-8(12)9(7)10(13)14-4/h7,9H,5-6H2,1-4H3
• InChIKey: ZYRYVGBRDTVCMK-UHFFFAOYSA-N

Properties

• Density: 0.996g/cm³ (Cal.)
• Boiling point: 256.482°C at 760 mmHg (Cal.)
• Flash point: 105.499°C (Cal.)