[(1alpha,4beta)-4-[3-(2-Chloroethyl)-3-Nitrosoureido]Cyclohexyl]Acetic Acid Methyl Ester
[CAS# 61137-49-3]

Identification

• Name: [(1alpha,4beta)-4-[3-(2-Chloroethyl)-3-Nitrosoureido]Cyclohexyl]Acetic Acid Methyl Ester
• Synonyms: [4-[(2-Chloroethyl-Nitroso-Carbamoyl)Amino]Cyclohexyl]Methyl Acetate; Acetic Acid [4-[[(2-Chloroethyl-Nitrosoamino)-Oxomethyl]Amino]Cyclohexyl]Methyl Ester; Acetic Acid [4-[(2-Chloroethyl-Nitroso-Carbamoyl)Amino]Cyclohexyl]Methyl Ester
• Molecular Formula: C₁₂H₂₀ClN₃O₄
• Molecular Weight: 305.76
• CAS Registry Number: 61137-49-3
• SMILES: C(OC(C)=O)C1CCC(CC1)NC(=O)N(CCCl)N=O
• InChI: 1S/C12H20ClN3O4/c1-9(17)20-8-10-2-4-11(5-3-10)14-12(18)16(15-19)7-6-13/h10-11H,2-8H2,1H3,(H,14,18)
• InChIKey: GSUNXHODQPCMLL-UHFFFAOYSA-N

Properties

• Density: 1.363g/cm³ (Cal.)