1,3-Diazetidin-2-one

Base Information

• Chemical Name: 1,3-Diazetidin-2-one
• CAS No.: 5265-50-9
• Molecular Formula: C2H4N2O
• Molecular Weight: 72.07
• DSSTox Substance ID: DTXSID80477599
• Nikkaji Number: J13.313B
• Wikidata: Q82310392
• Mol file: 5265-50-9.mol

Synonyms:1,3-Diazetidin-2-one;Methylenharnstoff;5265-50-9;DTXSID80477599

Chemical Property of 1,3-Diazetidin-2-one

Chemical Property:

• PKA: 13.09±0.20(Predicted)
• Density: 1.210±0.06 g/cm3(Predicted)
• XLogP3: -0.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 72.032362755
• Heavy Atom Count: 5
• Complexity: 54.7

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1NC(=O)N1