Metheptazine
[CAS# 469-78-3]

Identification

• Name: Metheptazine
• Synonyms: Methyl 1,2-Dimethyl-4-Phenyl-Azepane-4-Carboxylate; 1,2-Dimethyl-4-Phenyl-4-Azepanecarboxylic Acid Methyl Ester; 1,2-Dimethyl-4-Phenyl-Azepane-4-Carboxylic Acid Methyl Ester
• Molecular Formula: C₁₆H₂₃NO₂
• Molecular Weight: 261.36
• CAS Registry Number: 469-78-3
• SMILES: C1=CC=CC=C1C2(CC(N(C)CCC2)C)C(OC)=O
• InChI: 1S/C16H23NO2/c1-13-12-16(15(18)19-3,10-7-11-17(13)2)14-8-5-4-6-9-14/h4-6,8-9,13H,7,10-12H2,1-3H3
• InChIKey: RAAFYFKWMRWOIT-UHFFFAOYSA-N

Properties

• Density: 1.023g/cm³ (Cal.)
• Boiling point: 340.147°C at 760 mmHg (Cal.)
• Flash point: 111.16°C (Cal.)