Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso-

Base Information

• Chemical Name: Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso-
• CAS No.: 69112-99-8
• Molecular Formula: C6H11Cl2N3O2
• Molecular Weight: 228.10
• DSSTox Substance ID: DTXSID80219173
• Nikkaji Number: J58.070H
• Wikidata: Q83096086
• Mol file: 69112-99-8.mol

Synonyms:BRN 2263769;Nitrosomethylbis(chloroethyl)urea;Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso-;1,1-Bis-(2-chloroethyl)-3-methyl-3-nitrosourea;1-Nitroso-1-methyl-3,3-bis-(2-chloroethyl)urea;3-Nitroso-1,1-bis-(2-chloroethyl)-3-methylurea;69112-99-8;C6H11Cl2N3O2;1,1-bis(2-chloroethyl)-3-methyl-3-nitrosourea;DTXSID80219173;C6-H11-Cl2-N3-O2;N-nitroso-methyl-bis-chloroethylurea;LS-159034;Urea, N,N-bis(2-chloroethyl)-N'-methyl-N'-nitroso-

Chemical Property of Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso-

Chemical Property:

• Vapor Pressure: 0.00252mmHg at 25°C
• Refractive Index: 1.6100 (estimate)
• Boiling Point: 287.2°Cat760mmHg
• Flash Point: 127.5°C
• PSA: 52.98000
• Density: 1.35g/cm³
• LogP: 1.49920
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 227.0228320
• Heavy Atom Count: 13
• Complexity: 173

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Nitrogen Compounds -> Nitrosamines
• Canonical SMILES: CN(C(=O)N(CCCl)CCCl)N=O