P(1),P(2)-二(5'-吡哆醛)二磷酸酯
[CAS# 67279-83-8]

基本信息

• 产品名称: P(1),P(2)-二(5'-吡哆醛)二磷酸酯
• 英文名: P(1),P(2)-Bis(5'-Pyridoxal)Diphosphate
• 别名: [(4-Formyl-5-Hydroxy-6-Methyl-3-Pyridyl)Methoxy-Hydroxy-Phosphoryl] (4-Formyl-5-Hydroxy-6-Methyl-3-Pyridyl)Methyl Hydrogen Phosphate; [(4-Formyl-5-Hydroxy-6-Methyl-3-Pyridyl)Methoxy-Hydroxyphosphoryl] (4-Formyl-5-Hydroxy-6-Methyl-3-Pyridyl)Methyl Hydrogen Phosphate; [Hydroxy-[(5-Hydroxy-4-Methanoyl-6-Methyl-Pyridin-3-Yl)Methoxy]Phosphoryl] (5-Hydroxy-4-Methanoyl-6-Methyl-Pyridin-3-Yl)Methyl Hydrogen Phosphate
• 分子式: C₁₆H₁₈N₂O₁₁P₂
• 分子量: 476.27
• CAS 登录号: 67279-83-8
• 分子行输入简码 SMILES: C1=NC(=C(O)C(=C1CO[P](O[P](OCC2=C(C(=C(N=C2)C)O)C=O)(=O)O)(=O)O)C=O)C
• 国际化学标识码 InChI: 1S/C16H18N2O11P2/c1-9-15(21)13(5-19)11(3-17-9)7-27-30(23,24)29-31(25,26)28-8-12-4-18-10(2)16(22)14(12)6-20/h3-6,21-22H,7-8H2,1-2H3,(H,23,24)(H,25,26)
• 国际化学标识检索码 InChIKey: AUVUJYCKFHLZTM-UHFFFAOYSA-N

物理化学性质

• 密度: 1.674g/cm³ （计算值）
• 沸点: 800.005°C at 760 mmHg （计算值）
• 闪点: 437.628°C （计算值）