1-[({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}Amino)Methyl]Cyclohexanecarboxylic Acid
[CAS# 204514-23-8]

Identification

• Name: 1-[({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}Amino)Methyl]Cyclohexanecarboxylic Acid
• Synonyms: 1-(Aminomethyl)cyclohexanecarboxylic acid, N-BOC protected; 1-Bocaminomethyl-cyclohexanecarboxylic acid x HCl; Boc-1-aminomethyl-cyclohexane carboxylic acid
• Molecular Formula: C₁₃H₂₃NO₄
• Molecular Weight: 257.33
• CAS Registry Number: 204514-23-8
• SMILES: OC(=O)C1(CNC(=O)OC(C)(C)C)CCCCC1
• InChI: 1S/C13H23NO4/c1-12(2,3)18-11(17)14-9-13(10(15)16)7-5-4-6-8-13/h4-9H2,1-3H3,(H,14,17)(H,15,16)
• InChIKey: GMSHYZKSGLWHSC-UHFFFAOYSA-N

Properties

• Density: 1.104g/cm³ (Cal.)
• Boiling point: 404.76°C at 760 mmHg (Cal.)
• Flash point: 198.592°C (Cal.)
• Refractive index: 1.485 (Cal.)