Methyl Hexahydro-alpha-Methyl-1H-Azepine-1-Propionate
[CAS# 4151-05-7]

Identification

• Name: Methyl Hexahydro-alpha-Methyl-1H-Azepine-1-Propionate
• Synonyms: Methyl 3-(Azepan-1-Yl)-2-Methyl-Propanoate; 3-(1-Azepanyl)-2-Methylpropanoic Acid Methyl Ester; 3-(Azepan-1-Yl)-2-Methyl-Propionic Acid Methyl Ester
• Molecular Formula: C₁₁H₂₁NO₂
• Molecular Weight: 199.29
• CAS Registry Number: 4151-05-7
• EINECS: 223-977-7
• SMILES: C(N1CCCCCC1)C(C(OC)=O)C
• InChI: 1S/C11H21NO2/c1-10(11(13)14-2)9-12-7-5-3-4-6-8-12/h10H,3-9H2,1-2H3
• InChIKey: RGTNCOFLOIQTDF-UHFFFAOYSA-N

Properties

• Density: 0.966g/cm³ (Cal.)
• Boiling point: 273.366°C at 760 mmHg (Cal.)
• Flash point: 96.776°C (Cal.)