Azepan-1-Yl-(3-Methylphenyl)Methanone
[CAS# 20308-68-3]

Identification

• Name: Azepan-1-Yl-(3-Methylphenyl)Methanone
• Synonyms: 1-Azepanyl-(3-Methylphenyl)Methanone; 1-(3-Methylbenzoyl)Azepane; Mls000532777
• Molecular Formula: C₁₄H₁₉NO
• Molecular Weight: 217.31
• CAS Registry Number: 20308-68-3
• SMILES: C2=C(C(=O)N1CCCCCC1)C=CC=C2C
• InChI: 1S/C14H19NO/c1-12-7-6-8-13(11-12)14(16)15-9-4-2-3-5-10-15/h6-8,11H,2-5,9-10H2,1H3
• InChIKey: SSWODRVIEQMLGC-UHFFFAOYSA-N

Properties

• Density: 1.042g/cm³ (Cal.)
• Boiling point: 365.925°C at 760 mmHg (Cal.)
• Flash point: 166.779°C (Cal.)