3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-

Base Information

• Chemical Name: 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-
• CAS No.: 57269-63-3
• Molecular Formula: C₉H₁₆N₂O
• Molecular Weight: 168.239
• DSSTox Substance ID: DTXSID40972772

Synonyms:1-(2,7-Diazabicyclo[3.2.1]octan-7-yl)propan-1-one;BRN 0608185;DTXSID40972772

Chemical Property of 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-

Chemical Property:

• Vapor Pressure: 0.000608mmHg at 25°C
• Boiling Point: 310.2°Cat760mmHg
• PKA: 9.07±0.20(Predicted)
• Flash Point: 141.4°C
• PSA: 32.34000
• Density: 1.066g/cm³
• LogP: 0.62590
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 168.126263138
• Heavy Atom Count: 12
• Complexity: 193

Purity/Quality:

99% ^*data from raw suppliers

8-PROPIONYL-3,8-DIAZABICYCLO[3.2.1]OCTANE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(=O)N1CC2CCNC1C2

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