3-(2-Amino-3-Hydroxy-3-Oxopropyl)Sulfanyl-3-(3H-Imidazol-4-Yl)Propanoic Acid
[CAS# 134381-43-4]

Identification

• Name: 3-(2-Amino-3-Hydroxy-3-Oxopropyl)Sulfanyl-3-(3H-Imidazol-4-Yl)Propanoic Acid
• Synonyms: 3-(2-Amino-3-Hydroxy-3-Oxo-Propyl)Sulfanyl-3-(3H-Imidazol-4-Yl)Propanoic Acid; 3-[(2-Amino-3-Hydroxy-3-Oxopropyl)Thio]-3-(3H-Imidazol-4-Yl)Propanoic Acid; 3-[(2-Amino-3-Hydroxy-3-Keto-Propyl)Thio]-3-(3H-Imidazol-4-Yl)Propionic Acid
• Molecular Formula: C₉H₁₃N₃O₄S
• Molecular Weight: 259.28
• CAS Registry Number: 134381-43-4
• SMILES: C1=C([NH]C=N1)C(SCC(N)C(=O)O)CC(=O)O
• InChI: 1S/C9H13N3O4S/c10-5(9(15)16)3-17-7(1-8(13)14)6-2-11-4-12-6/h2,4-5,7H,1,3,10H2,(H,11,12)(H,13,14)(H,15,16)
• InChIKey: ABJUPPXFQYZWTK-UHFFFAOYSA-N

Properties

• Density: 1.545g/cm³ (Cal.)
• Boiling point: 605.698°C at 760 mmHg (Cal.)
• Flash point: 320.115°C (Cal.)