3-(2-Chloroethyl)-1-[2-[2-(2-Chloroethylcarbamoyl-Nitrosoamino)Ethyldisulfanyl]Ethyl]-1-Nitrosourea
[CAS# 77456-14-5]

Identification

• Name: 3-(2-Chloroethyl)-1-[2-[2-(2-Chloroethylcarbamoyl-Nitrosoamino)Ethyldisulfanyl]Ethyl]-1-Nitrosourea
• Synonyms: 3-(2-Chloroethyl)-1-[2-[2-(2-Chloroethylcarbamoyl-Nitroso-Amino)Ethyldisulfanyl]Ethyl]-1-Nitroso-Urea; 3-(2-Chloroethyl)-1-[2-[2-[[(2-Chloroethylamino)-Oxomethyl]-Nitrosoamino]Ethyldisulfanyl]Ethyl]-1-Nitrosourea; 1,1'-Dithiodiethylenebis(3-(2-Chloroethyl)-1-Nitrosourea)
• Molecular Formula: C₁₀H₁₈Cl₂N₆O₄S₂
• Molecular Weight: 421.32
• CAS Registry Number: 77456-14-5
• SMILES: C(N(C(=O)NCCCl)N=O)CSSCCN(C(NCCCl)=O)N=O
• InChI: 1S/C10H18Cl2N6O4S2/c11-1-3-13-9(19)17(15-21)5-7-23-24-8-6-18(16-22)10(20)14-4-2-12/h1-8H2,(H,13,19)(H,14,20)
• InChIKey: MCJTWBSHHKUHDE-UHFFFAOYSA-N

Properties

• Density: 1.556g/cm³ (Cal.)