H-His-Tyr-OH
[CAS# 35979-00-1]

Identification

• Name: H-His-Tyr-OH
• Synonyms: 2-[[2-Amino-3-(3H-Imidazol-4-Yl)-1-Oxopropyl]Amino]-3-(4-Hydroxyphenyl)Propanoic Acid; 2-[[2-Amino-3-(3H-Imidazol-4-Yl)Propanoyl]Amino]-3-(4-Hydroxyphenyl)Propionic Acid; Nsc374121
• Molecular Formula: C₁₅H₁₈N₄O₄
• Molecular Weight: 318.33
• CAS Registry Number: 35979-00-1
• SMILES: C2=C(CC(NC(C(CC1=CN=C[NH]1)N)=O)C(O)=O)C=CC(=C2)O
• InChI: 1S/C15H18N4O4/c16-12(6-10-7-17-8-18-10)14(21)19-13(15(22)23)5-9-1-3-11(20)4-2-9/h1-4,7-8,12-13,20H,5-6,16H2,(H,17,18)(H,19,21)(H,22,23)
• InChIKey: HTOOKGDPMXSJSY-UHFFFAOYSA-N

Properties

• Density: 1.421g/cm³ (Cal.)
• Boiling point: 763.357°C at 760 mmHg (Cal.)
• Flash point: 415.463°C (Cal.)