alpha-Methylhistidine
[CAS# 587-20-2]

Identification

• Name: alpha-Methylhistidine
• Synonyms: (2S)-2-Amino-3-(3H-Imidazol-4-Yl)-2-Methyl-Propanoic Acid; (2S)-2-Amino-3-(3H-Imidazol-4-Yl)-2-Methyl-Propionic Acid; Histidine, Alpha-Methyl-
• Molecular Formula: C₇H₁₁N₃O₂
• Molecular Weight: 169.18
• CAS Registry Number: 587-20-2
• SMILES: [C@@](C(=O)O)(N)(CC1=CN=C[NH]1)C
• InChI: 1S/C7H11N3O2/c1-7(8,6(11)12)2-5-3-9-4-10-5/h3-4H,2,8H2,1H3,(H,9,10)(H,11,12)/t7-/m0/s1
• InChIKey: HRRYYCWYCMJNGA-ZETCQYMHSA-N

Properties

• Density: 1.352g/cm³ (Cal.)
• Boiling point: 439.417°C at 760 mmHg (Cal.)
• Flash point: 219.552°C (Cal.)