N-methyl-N-(2,3,4,5,6-pentahydroxyhexyl)octanamide

• ChemBase编号: 102952
• 分子式: C15H31NO6
• 平均质量: 321.40974
• 单一同位素质量: 321.21513772
• SMILES: CCCCCCCC(=O)N(C)CC(O)C(O)C(O)C(O)CO
• Canonical SMILES: CCCCCCCC(=O)N(CC(C(C(C(CO)O)O)O)O)C
• InChI: InChI=1S/C15H31NO6/c1-3-4-5-6-7-8-13(20)16(2)9-11(18)14(21)15(22)12(19)10-17/h11-12,14-15,17-19,21-22H,3-10H2,1-2H3
• InChIKey: SBWGZAXBCCNRTM-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: N-methyl-N-(2,3,4,5,6-pentahydroxyhexyl)octanamide
• IUPAC传统名: N-methyl-N-(2,3,4,5,6-pentahydroxyhexyl)octanamide
• 别名: Octanoyl-N-methylglucamide; N-(D-Glucityl)-N-methyloctanamide; OMEGA; N-Methyl-N-octanoyl-D-glucamine; MEGA-8

登记号

• CAS号: 85316-98-9
• PubChem SID: 162091267
• PubChem CID: 4377671

理论计算性质

• Acid pKa: 12.646883
• 质子受体: 6
• 质子供体: 5
• LogD (pH = 5.5): -0.87100077
• LogD (pH = 7.4): -0.8710013
• Log P: -0.8709988
• 摩尔折射率: 82.0335 cm^3
• 极化性: 32.75603 Å^3
• 极化表面积: 121.46 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: Room Temperature (15-30°C)

产品相关信息

• 纯度: ~98%

详细说明

MP Biomedicals - 02150055

Purity: ~98%
A nonionic detergent, transparent in UV region. Excellent for use as a membrane protein solubilizer.

参考文献

• Hildreth, J.E.K., Biochem. J. , 207 : 3636, (1982).