3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60-icosaoxahexaheptacontan-1-ol

• ChemBase编号: 153668
• 分子式: C56H114O21
• 平均质量: 1123.49176
• 单一同位素质量: 1122.78526067
• SMILES: CCCCCCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO
• Canonical SMILES: CCCCCCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO
• InChI: InChI=1S/C56H114O21/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-58-19-21-60-23-25-62-27-29-64-31-33-66-35-37-68-39-41-70-43-45-72-47-49-74-51-53-76-55-56-77-54-52-75-50-48-73-46-44-71-42-40-69-38-36-67-34-32-65-30-28-63-26-24-61-22-20-59-18-16-57/h57H,2-56H2,1H3
• InChIKey: NLMKTBGFQGKQEV-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60-icosaoxahexaheptacontan-1-ol
• IUPAC传统名: 3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60-icosaoxahexaheptacontan-1-ol
• 别名: 聚乙二醇十六烷基醚; Polyoxyethylene (20) cetyl ether; Polyethylene glycol hexadecyl ether; Brij® 58

登记号

• CAS号: 9004-95-9
• MDL号: MFCD00080892
• Beilstein号: 1899885
• PubChem SID: 24849847; 162247807; 24898715
• PubChem CID: 2724259

理论计算性质

• Acid pKa: 15.121156
• 质子受体: 21
• 质子供体: 1
• LogD (pH = 5.5): 5.200636
• LogD (pH = 7.4): 5.200636
• Log P: 5.200636
• 摩尔折射率: 298.2169 cm^3
• 极化性: 118.50353 Å^3
• 极化表面积: 204.83 Å^2
• 可自由旋转的化学键: 74
• 里宾斯基五规则: false

分子性质

理化性质

• 熔点: ~38 °C; 41-49 °C
• 闪点: 150 °C; 302 °F
• 临界胶束浓度: 0.08 mM(20-25°C)
• 胶束聚集数: 70
• 转变温度: cloud point >100 °C
• 亲水亲油平衡值: 15.7; 16

安全信息

• RTECS编号: TR1581470
• 德国WGK号: 2
• 个人保护装置: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

产品相关信息

• 简要说明: non-ionic
• Mol. Weight: average Mn ~1124; micellar avg mol wt 79,000
• 线性分子式: HO(CH2CH2O)20C16H33

详细说明

Sigma Aldrich - P5884

Application
Non-ionic detergent for protein extraction, permeabilization of cells; may be used in the preparation of yeast spheroplasts.
包装
1 kg in poly bottle
100, 500 g in poly bottle
法律信息
Brij is a registered trademark of Uniqema Americas LLC

Sigma Aldrich - 16004

法律信息
Brij is a registered trademark of Uniqema Americas LLC