(2S,4R)-5-Amino-2-Ammonio-4-Fluoro-5-Oxopentanoate
[CAS# 238418-71-8]

Identification

• Name: (2S,4R)-5-Amino-2-Ammonio-4-Fluoro-5-Oxopentanoate
• Synonyms: (2S,4R)-2,5-diamino-4-fluoro-5-oxopentanoic acid; DL-erythro-4-Fluoroglutamine 99%; ZINC02526229
• Molecular Formula: C₅H₉FN₂O₃
• Molecular Weight: 164.13
• CAS Registry Number: 238418-71-8
• SMILES: [O-]C(=O)[C@@H]([NH3+])C[C@@H](F)C(=O)N
• InChI: 1S/C5H9FN2O3/c6-2(4(8)9)1-3(7)5(10)11/h2-3H,1,7H2,(H2,8,9)(H,10,11)/t2-,3+/m1/s1
• InChIKey: PGEYFCBAWGQSGT-GBXIJSLDSA-N

Properties

• Density: 1.41g/cm³ (Cal.)
• Boiling point: 462.509°C at 760 mmHg (Cal.)
• Flash point: 233.517°C (Cal.)
• Refractive index: 1.495 (Cal.)