2,5-dioxopyrrolidin-1-yl dodecanoate

• ChemBase编号: 102866
• 分子式: C16H27NO4
• 平均质量: 297.38988
• 单一同位素质量: 297.19400835
• SMILES: CCCCCCCCCCCC(=O)ON1C(=O)CCC1=O
• Canonical SMILES: CCCCCCCCCCCC(=O)ON1C(=O)CCC1=O
• InChI: InChI=1S/C16H27NO4/c1-2-3-4-5-6-7-8-9-10-11-16(20)21-17-14(18)12-13-15(17)19/h2-13H2,1H3
• InChIKey: LRKGVVJOUNKTGG-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 2,5-dioxopyrrolidin-1-yl dodecanoate
• IUPAC传统名: 2,5-dioxopyrrolidin-1-yl dodecanoate
• 别名: Succinimidyl laurate; LAURIC ACID-N-HYDROXYSUCCINIMIDE ESTER; Lauric acid N-hydroxysuccinimide ester

登记号

• CAS号: 14565-47-0
• MDL号: MFCD00050401
• PubChem SID: 162091204; 24896358
• PubChem CID: 2802515

理论计算性质

• Acid pKa: 17.709124
• 质子受体: 3
• 质子供体: 0
• LogD (pH = 5.5): 3.8478935
• LogD (pH = 7.4): 3.8478935
• Log P: 3.8478935
• 摩尔折射率: 79.2334 cm^3
• 极化性: 31.542976 Å^3
• 极化表面积: 63.68 Å^2
• 可自由旋转的化学键: 12
• 里宾斯基五规则: true

分子性质

安全信息

• 保存条件: 0°C
• 德国WGK号: 3
• 保存温度: -20°C

产品相关信息

• 纯度: ~98% (TLC)
• Empirical Formula (Hill Notation): C16H27NO4

详细说明

MP Biomedicals - 02104817

Acetylating Agent

Sigma Aldrich - L3900

Biochem/physiol Actions
Lauric acid N-hydroxysuccinimide ester may be used for the synthesis of N-acylamino acids and lipidization of polypeptides or other applications that use N-hydroxysuccinimide ester conjugation chemistry.