2,5-dioxopyrrolidin-1-yl tetradecanoate

• ChemBase编号: 177937
• 分子式: C18H31NO4
• 平均质量: 325.44304
• 单一同位素质量: 325.22530848
• SMILES: CCCCCCCCCCCCCC(=O)ON1C(=O)CCC1=O
• Canonical SMILES: CCCCCCCCCCCCCC(=O)ON1C(=O)CCC1=O
• InChI: InChI=1S/C18H31NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-18(22)23-19-16(20)14-15-17(19)21/h2-15H2,1H3
• InChIKey: NZEDHZOVUDEBGW-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 2,5-dioxopyrrolidin-1-yl tetradecanoate
• IUPAC传统名: 2,5-dioxopyrrolidin-1-yl tetradecanoate
• 别名: 1-[(1-oxotetradecyl)oxy]-2,5-Pyrrolidinedione; Myristic acid N-hydroxysuccinimide ester; N-Hydroxysuccinimide myristate; Tetradecanoic acid N-hydroxysuccinimide ester; N-Succinimidyl Myristate

登记号

• CAS号: 69888-86-4
• PubChem SID: 164233847
• PubChem CID: 4229289

理论计算性质

• Acid pKa: 17.709124
• 质子受体: 3
• 质子供体: 0
• LogD (pH = 5.5): 4.737031
• LogD (pH = 7.4): 4.737031
• Log P: 4.737031
• 摩尔折射率: 88.4354 cm^3
• 极化性: 35.214638 Å^3
• 极化表面积: 63.68 Å^2
• 可自由旋转的化学键: 14
• 里宾斯基五规则: true

分子性质

理化性质

• 溶解度: Acetone; Dichloromethane; Toluene
• 外观: White Solid
• 熔点: 80-81°C

安全信息

• 保存条件: Hygroscopic, -20°C Freezer, Under Inert Atmosphere
• 保存注意事项: Moisture Sensitive

详细说明

Toronto Research Chemicals - S690800

Used to make cationic polysaccharide compositions for transfection

参考文献

• Faroux-Corlay, B., et al.: J. Med. Chem., 44, 2188 (2001)
• Georgiades, S.N., et al.: Bioorg. Med. Chem. Lett., 18, 3117 (2001)