(3R)-3-Amino-6-(3-methylphenyl)-2-azepanone
[CAS# 784156-08-7]

Identification

• Name: (3R)-3-Amino-6-(3-methylphenyl)-2-azepanone
• Synonyms: (3R)-3-amino-6-(m-tolyl)azepan-2-one
• Molecular Formula: C₁₃H₁₈N₂O
• Molecular Weight: 218.29
• CAS Registry Number: 784156-08-7
• SMILES: Cc1cccc(c1)C2CC[C@H](C(=O)NC2)N
• InChI: 1S/C13H18N2O/c1-9-3-2-4-10(7-9)11-5-6-12(14)13(16)15-8-11/h2-4,7,11-12H,5-6,8,14H2,1H3,(H,15,16)/t11?,12-/m1/s1
• InChIKey: XTBJBHQEXIAIGW-PIJUOVFKSA-N

Properties

• Density: 1.066g/cm³ (Cal.)
• Boiling point: 429.433°C at 760 mmHg (Cal.)
• Flash point: 213.514°C (Cal.)
• Refractive index: 1.537 (Cal.)