2-hydroxy-2-oxoacetate,4-[1-(2-phenylethyl)pyrrolidin-1-ium-3-yl]-1,4-benzoxazin-3-one

• 常用名: 2-hydroxy-2-oxoacetate,4-[1-(2-phenylethyl)pyrrolidin-1-ium-3-yl]-1,4-benzoxazin-3-one
• 英文名: 2-hydroxy-2-oxoacetate,4-[1-(2-phenylethyl)pyrrolidin-1-ium-3-yl]-1,4-benzoxazin-3-one
• CAS号: 23247-06-5
• 分子量: 412.43600
• 密度: N/A
• 沸点: N/A
• 分子式: C₂₂H₂₄N₂O₆
• 熔点: N/A
• 闪点: N/A

名称

• 英文名: 2-hydroxy-2-oxoacetate,4-[1-(2-phenylethyl)pyrrolidin-1-ium-3-yl]-1,4-benzoxazin-3-one

物理化学性质

• 分子式: C₂₂H₂₄N₂O₆
• 分子量: 412.43600
• 精确质量: 412.16300
• PSA: 107.38000
• LogP: 1.88750
• InChIKey: NKEONMFPIRYHAL-UHFFFAOYSA-N
• SMILES: O=C([O-])C(=O)O.O=C1COc2ccccc2N1C1CC[NH+](CCc2ccccc2)C1
• 蒸汽压: 2.97E-11mmHg at 25°C

英文别名

• 4-(1-phenethylpyrrolidin-1-ium-3-yl)-1,4-benzoxazin-3-one
• 2H-1,4-BENZOXAZIN-3(4H)-ONE,4-(1-PHENETHYL-3-PYRROLIDINYL)-,OXALATE (1:1)
• 4-[1-(2-phenylethyl)pyrrolidin-3-yl]-2H-1,4-benzoxazin-3(4H)-one ethanedioate
• 4-(1-Phenethyl-3-pyrrolidinyl)-2H-1,4-benzoxazin-3(4H)-one oxalate (1:1)