3-Methyl-1-(2-methyl-2-propanyl)-4-phenyl-2(1H)-azetone
[CAS# 827613-86-5]

Identification

• Name: 3-Methyl-1-(2-methyl-2-propanyl)-4-phenyl-2(1H)-azetone
• Synonyms: 2(1H)-Azetone, 1-(1,1-dimethylethyl)-3-methyl-4-phenyl-; 3-Methyl-1-(2-methyl-2-propanyl)-4-phenyl-2(1H)-azeton; 3-Methyl-1-(2-methyl-2-propanyl)-4-phenyl-2(1H)-azetone
• Molecular Formula: C₁₄H₁₇NO
• Molecular Weight: 215.29
• CAS Registry Number: 827613-86-5
• SMILES: CC1=C(N(C1=O)C(C)(C)C)c2ccccc2
• InChI: 1S/C14H17NO/c1-10-12(11-8-6-5-7-9-11)15(13(10)16)14(2,3)4/h5-9H,1-4H3
• InChIKey: BXOKZUVKRSHDBZ-UHFFFAOYSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 366.8±31.0°C at 760 mmHg (Cal.)
• Flash point: 168.4±16.0°C (Cal.)
• Refractive index: 1.564 (Cal.)