(2S)-2-{[N-(Ammonioacetyl)-L-Phenylalanyl]Amino}Propanoate
[CAS# 17123-30-7]

Identification

• Name: (2S)-2-{[N-(Ammonioacetyl)-L-Phenylalanyl]Amino}Propanoate
• Synonyms: H-GLY-PHE-ALA-OH; ZINC02390900
• Molecular Formula: C₁₄H₁₉N₃O₄
• Molecular Weight: 293.32
• CAS Registry Number: 17123-30-7
• SMILES: [O-]C(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[NH3+])Cc1ccccc1)C
• InChI: 1S/C14H19N3O4/c1-9(14(20)21)16-13(19)11(17-12(18)8-15)7-10-5-3-2-4-6-10/h2-6,9,11H,7-8,15H2,1H3,(H,16,19)(H,17,18)(H,20,21)/t9-,11-/m0/s1
• InChIKey: WMGHDYWNHNLGBV-ONGXEEELSA-N

Properties

• Density: 1.263g/cm³ (Cal.)
• Boiling point: 665.562°C at 760 mmHg (Cal.)
• Flash point: 356.319°C (Cal.)
• Refractive index: 1.567 (Cal.)