Nitrosourea

Base Information

• Chemical Name: Nitrosourea
• CAS No.: 13010-20-3
• Molecular Formula: CH₃N₃O₂
• Molecular Weight: 89.0537
• European Community (EC) Number: 846-796-0
• UNII: S0W1V6314Y
• DSSTox Substance ID: DTXSID80156337
• Nikkaji Number: J93.297C
• Wikipedia: Nitrosourea
• Wikidata: Q418311
• Mol file: 13010-20-3.mol

Synonyms:Nitrosourea;N-Nitrosourea;13010-20-3;Urea, nitroso-;Urea, N-nitroso-;UNII-S0W1V6314Y;S0W1V6314Y;N-nitroso urea;CH3N3O2;DTXSID80156337;C-H3-N3-O2;AKOS006339961;FT-0686496;Q418311

Chemical Property of Nitrosourea

Chemical Property:

• Melting Point: 111-111.3 °C (decomp)
• Refractive Index: 1.4451 (estimate)
• Boiling Point: °Cat760mmHg
• PKA: 7.43±0.46(Predicted)
• Flash Point: °C
• PSA: 89.03000
• Density: 1.82g/cm³
• LogP: 0.42030
• XLogP3: -0.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 89.022526347
• Heavy Atom Count: 6
• Complexity: 69.2

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(=O)(N)NN=O