L-Alanyl-2-(alanylamino)-L-alanine
[CAS# 859283-57-1]

Identification

• Name: L-Alanyl-2-(alanylamino)-L-alanine
• Synonyms: (2S)-2-((S)-2-aminopropanamido)-2-(2-aminopropanamido)propanoic acid
• Molecular Formula: C₉H₁₈N₄O₄
• Molecular Weight: 246.26
• CAS Registry Number: 859283-57-1
• SMILES: C[C@@H](C(=O)N[C@@](C)(C(=O)O)NC(=O)C(C)N)N
• InChI: 1S/C9H18N4O4/c1-4(10)6(14)12-9(3,8(16)17)13-7(15)5(2)11/h4-5H,10-11H2,1-3H3,(H,12,14)(H,13,15)(H,16,17)/t4-,5?,9+/m0/s1
• InChIKey: XUWLOTMTVFBDFG-NCNCNYBLSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 583.3±50.0°C at 760 mmHg (Cal.)
• Flash point: 306.6±30.1°C (Cal.)
• Refractive index: 1.533 (Cal.)