alpha-Fluoromethylhistidine
[CAS# 70050-43-0]

Identification

• Name: alpha-Fluoromethylhistidine
• Synonyms: 2-Amino-2-(Fluoromethyl)-3-(3H-Imidazol-4-Yl)Propionic Acid; Histidine, Alpha-(Fluoromethyl)- (9Ci); Imidazole-4-Propionic Acid, Alpha-Amino-Alpha-(Fluoromethyl)-
• Molecular Formula: C₇H₁₀FN₃O₂
• Molecular Weight: 187.17
• CAS Registry Number: 70050-43-0
• SMILES: C1=C([NH]C=N1)CC(N)(C(=O)O)CF
• InChI: 1S/C7H10FN3O2/c8-3-7(9,6(12)13)1-5-2-10-4-11-5/h2,4H,1,3,9H2,(H,10,11)(H,12,13)
• InChIKey: AJFGLTPLWPTALJ-UHFFFAOYSA-N

Properties

• Density: 1.433g/cm³ (Cal.)
• Boiling point: 483.975°C at 760 mmHg (Cal.)
• Flash point: 246.499°C (Cal.)