Diethyl [[[3-[[[3-Ethoxy-2-(Ethoxycarbonyl)-1,3-Dioxopropyl]Amino]Methyl]-3,5,5-Trimethylcyclohexyl]Amino]Carbonyl]Malonate
[CAS# 58873-16-8]

Identification

• Name: Diethyl [[[3-[[[3-Ethoxy-2-(Ethoxycarbonyl)-1,3-Dioxopropyl]Amino]Methyl]-3,5,5-Trimethylcyclohexyl]Amino]Carbonyl]Malonate
• Synonyms: Diethyl 2-[[5-[[(3-Ethoxy-2-Ethoxycarbonyl-3-Oxo-Propanoyl)Amino]Methyl]-2,2,4-Trimethyl-Cyclohexyl]Carbamoyl]Propanedioate; 2-[[[5-[[(3-Ethoxy-2-Ethoxycarbonyl-1,3-Dioxopropyl)Amino]Methyl]-2,2,4-Trimethylcyclohexyl]Amino]-Oxomethyl]Propanedioic Acid Diethyl Ester; 2-[[5-[[(2-Carbethoxy-3-Ethoxy-3-Keto-Propanoyl)Amino]Methyl]-2,2,4-Trimethyl-Cyclohexyl]Carbamoyl]Malonic Acid Diethyl Ester
• Molecular Formula: C₂₆H₄₂N₂O₁₀
• Molecular Weight: 542.63
• CAS Registry Number: 58873-16-8
• EINECS: 261-478-6
• SMILES: C(OC(C(C(NC1CC(C(CC1(C)C)C)CNC(C(C(=O)OCC)C(=O)OCC)=O)=O)C(=O)OCC)=O)C
• InChI: 1S/C26H42N2O10/c1-8-35-22(31)18(23(32)36-9-2)20(29)27-14-16-12-17(26(6,7)13-15(16)5)28-21(30)19(24(33)37-10-3)25(34)38-11-4/h15-19H,8-14H2,1-7H3,(H,27,29)(H,28,30)
• InChIKey: XVOSOGKEEMBJPN-UHFFFAOYSA-N

Properties

• Density: 1.182g/cm³ (Cal.)
• Boiling point: 683.881°C at 760 mmHg (Cal.)
• Flash point: 367.398°C (Cal.)