N-Hexanoyl-3-nitriloalanine
[CAS# 859307-48-5]

Identification

• Name: N-Hexanoyl-3-nitriloalanine
• Synonyms: 2-cyano-2-hexanamidoacetic acid
• Molecular Formula: C₉H₁₄N₂O₃
• Molecular Weight: 198.22
• CAS Registry Number: 859307-48-5
• SMILES: CCCCCC(=O)NC(C#N)C(=O)O
• InChI: 1S/C9H14N2O3/c1-2-3-4-5-8(12)11-7(6-10)9(13)14/h7H,2-5H2,1H3,(H,11,12)(H,13,14)
• InChIKey: CIJATKVKBRRVCL-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 434.0±40.0°C at 760 mmHg (Cal.)
• Flash point: 216.3±27.3°C (Cal.)
• Refractive index: 1.481 (Cal.)