4'-Carbamoylpyridoxamine 5'-Phosphate
[CAS# 136026-77-2]

Identification

• Name: 4'-Carbamoylpyridoxamine 5'-Phosphate
• Synonyms: [4-(1,2-Diamino-2-Oxo-Ethyl)-5-Hydroxy-6-Methyl-3-Pyridyl]Methyl Dihydrogen Phosphate; [4-(1,2-Diamino-2-Oxoethyl)-5-Hydroxy-6-Methyl-3-Pyridyl]Methyl Dihydrogen Phosphate; [4-(1,2-Diamino-2-Keto-Ethyl)-5-Hydroxy-6-Methyl-3-Pyridyl]Methyl Dihydrogen Phosphate
• Molecular Formula: C₉H₁₄N₃O₆P
• Molecular Weight: 291.20
• CAS Registry Number: 136026-77-2
• SMILES: C1=C(C(=C(C(=N1)C)O)C(N)C(N)=O)CO[P](=O)(O)O
• InChI: 1S/C9H14N3O6P/c1-4-8(13)6(7(10)9(11)14)5(2-12-4)3-18-19(15,16)17/h2,7,13H,3,10H2,1H3,(H2,11,14)(H2,15,16,17)
• InChIKey: BCNASWUFXWPLOY-UHFFFAOYSA-N

Properties

• Density: 1.643g/cm³ (Cal.)
• Boiling point: 733.037°C at 760 mmHg (Cal.)
• Flash point: 397.127°C (Cal.)