2-Methyl-N-Octanoylalanine
[CAS# 176664-71-4]

Identification

• Name: 2-Methyl-N-Octanoylalanine
• Synonyms: 2-methyl-2-octanamidopropanoic acid
• Molecular Formula: C₁₂H₂₃NO₃
• Molecular Weight: 229.32
• CAS Registry Number: 176664-71-4
• SMILES: CCCCCCCC(=O)NC(C)(C)C(=O)O
• InChI: 1S/C12H23NO3/c1-4-5-6-7-8-9-10(14)13-12(2,3)11(15)16/h4-9H2,1-3H3,(H,13,14)(H,15,16)
• InChIKey: PLXBHAOFRHUTEU-UHFFFAOYSA-N

Properties

• Density: 1.009g/cm³ (Cal.)
• Boiling point: 411.3°C at 760 mmHg (Cal.)
• Flash point: 202.547°C (Cal.)
• Refractive index: 1.465 (Cal.)