1-Methyl-16-azatetracyclo[7.6.1.0^2,7.0^10,15]hexadeca-2,4,6,10,12,14-hexaene
[CAS# 70449-94-4]

Identification

• Name: 1-Methyl-16-azatetracyclo[7.6.1.0^2,7.0^10,15]hexadeca-2,4,6,10,12,14-hexaene
• Synonyms: (-)-1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2(7),3,5,10(15),11,13-hexaene; (+)-1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2(7),3,5,10(15),11,13-hexaene; (MK-801)1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2(7),3,5,10(15),11,13-hexaene
• Molecular Formula: C₁₆H₁₅N
• Molecular Weight: 221.30
• CAS Registry Number: 70449-94-4
• EINECS: 274-609-7
• SMILES: CC12C3=CC=CC=C3CC(N1)C4=CC=CC=C24
• InChI: 1S/C16H15N/c1-16-13-8-4-2-6-11(13)10-15(17-16)12-7-3-5-9-14(12)16/h2-9,15,17H,10H2,1H3
• InChIKey: LBOJYSIDWZQNJS-UHFFFAOYSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 320.3±11.0°C at 760 mmHg (Cal.)
• Flash point: 152.6±14.7°C (Cal.)