(2S)-2-Amino-3-(2-Bromo-3H-Imidazol-4-Yl)Propanoic Acid
[CAS# 126663-36-3]

Identification

• Name: (2S)-2-Amino-3-(2-Bromo-3H-Imidazol-4-Yl)Propanoic Acid
• Synonyms: (2S)-2-Amino-3-(2-Bromo-3H-Imidazol-4-Yl)Propionic Acid; 2-Bromohistidine; 2-Bromo-L-Histidine
• Molecular Formula: C₆H₈BrN₃O₂
• Molecular Weight: 234.05
• CAS Registry Number: 126663-36-3
• SMILES: [C@H](C(=O)O)(N)CC1=CN=C([NH]1)Br
• InChI: 1S/C6H8BrN3O2/c7-6-9-2-3(10-6)1-4(8)5(11)12/h2,4H,1,8H2,(H,9,10)(H,11,12)/t4-/m0/s1
• InChIKey: NLVOWJVMOQAYDW-BYPYZUCNSA-N

Properties

• Density: 1.87g/cm³ (Cal.)
• Boiling point: 471.054°C at 760 mmHg (Cal.)
• Flash point: 238.685°C (Cal.)