2,6-Methano-4H-1,4-benzoxazocine

Base Information

• Chemical Name: 2,6-Methano-4H-1,4-benzoxazocine
• CAS No.: 318-81-0
• Molecular Formula: C11H9 N O
• Molecular Weight: 171.1953
• DSSTox Substance ID: DTXSID40185663
• Nikkaji Number: J41.743B
• Wikidata: Q83056732
• Mol file: 318-81-0.mol

Synonyms:2,6-Methano-4H-1,4-benzoxazocine;318-81-0;3-Aza-6,7-benzo-8-oxa-5-phenylbicyclo(3.3.1)nonane;DTXSID40185663

Chemical Property of 2,6-Methano-4H-1,4-benzoxazocine

Chemical Property:

• Vapor Pressure: 0.000278mmHg at 25°C
• Boiling Point: 322.5°Cat760mmHg
• Flash Point: 122.2°C
• PSA: 28.93000
• Density: 1.27g/cm³
• LogP: 2.78950
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 171.068413911
• Heavy Atom Count: 13
• Complexity: 195

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C2=CNC=C1OC3=CC=CC=C23