Ethyl 2-(4-methyl-1,4-diazepan-1-yl)benzoate
[CAS# 912569-58-5]

Identification

• Name: Ethyl 2-(4-methyl-1,4-diazepan-1-yl)benzoate
• Synonyms: ethyl 2-(4-methyl-1,4-diazaperhydroepinyl)benzoate; ethyl-2-(4-methylperhydro-1,4-diazepin-1-yl)benzoate
• Molecular Formula: C₁₅H₂₂N₂O₂
• Molecular Weight: 262.35
• CAS Registry Number: 912569-58-5
• SMILES: CN1CCCN(CC1)c2ccccc2C(=O)OCC
• InChI: 1S/C15H22N2O2/c1-3-19-15(18)13-7-4-5-8-14(13)17-10-6-9-16(2)11-12-17/h4-5,7-8H,3,6,9-12H2,1-2H3
• InChIKey: XAVHDPRFJKPWNA-UHFFFAOYSA-N

Properties

• Density: 1.071g/cm³ (Cal.)
• Boiling point: 379.483°C at 760 mmHg (Cal.)
• Flash point: 183.305°C (Cal.)
• Refractive index: 1.53 (Cal.)