Ethyl 7-(3-methylphenyl)-7-oxoheptanoate
[CAS# 898751-54-7]

Identification

• Name: Ethyl 7-(3-methylphenyl)-7-oxoheptanoate
• Synonyms: ethyl 7-(3-methylphenyl)-7-oxoheptanoate
• Molecular Formula: C₁₆H₂₂O₃
• Molecular Weight: 262.34
• CAS Registry Number: 898751-54-7
• SMILES: O=C(CCCCCC(=O)OCC)c1cccc(C)c1
• InChI: 1S/C16H22O3/c1-3-19-16(18)11-6-4-5-10-15(17)14-9-7-8-13(2)12-14/h7-9,12H,3-6,10-11H2,1-2H3
• InChIKey: XDSSXIYWLOQJJH-UHFFFAOYSA-N

Properties

• Density: 1.024g/cm³ (Cal.)
• Boiling point: 375.117°C at 760 mmHg (Cal.)
• Flash point: 162.961°C (Cal.)
• Refractive index: 1.499 (Cal.)