4alpha-[3-(2-Fluoroethyl)-3-Nitrosoureido]-1alpha-Cyclohexanecarboxylic Acid
[CAS# 61137-62-0]

Identification

• Name: 4alpha-[3-(2-Fluoroethyl)-3-Nitrosoureido]-1alpha-Cyclohexanecarboxylic Acid
• Synonyms: 4-[(2-Fluoroethyl-Nitroso-Carbamoyl)Amino]Cyclohexane-1-Carboxylic Acid; 4-[[(2-Fluoroethyl-Nitrosoamino)-Oxomethyl]Amino]-1-Cyclohexanecarboxylic Acid; Trans-3-(4-Carboxycyclohexyl)-1-(2-Fluoroethyl)-1-Nitrosourea
• Molecular Formula: C₁₀H₁₆FN₃O₄
• Molecular Weight: 261.25
• CAS Registry Number: 61137-62-0
• SMILES: C(N(C(NC1CCC(C(O)=O)CC1)=O)N=O)CF
• InChI: 1S/C10H16FN3O4/c11-5-6-14(13-18)10(17)12-8-3-1-7(2-4-8)9(15)16/h7-8H,1-6H2,(H,12,17)(H,15,16)
• InChIKey: YTWIKXYJTKQLDW-UHFFFAOYSA-N

Properties

• Density: 1.473g/cm³ (Cal.)