N-methyl-N-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]octanamide

• ChemBase编号: 138042
• 分子式: C15H31NO6
• 平均质量: 321.40974
• 单一同位素质量: 321.21513772
• SMILES: CCCCCCCC(=O)N(C)C[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O
• Canonical SMILES: CCCCCCCC(=O)N(C[C@@H]([C@H]([C@@H]([C@@H](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/t11-,12+,14+,15+/m0/s1
• InChIKey: SBWGZAXBCCNRTM-CTHBEMJXSA-N

名称和登记号

名称

• IUPAC标准名: N-methyl-N-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]octanamide
• IUPAC传统名: N-methyl-N-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]octanamide
• 别名: N-(D-葡糖基)-N-甲基辛酰胺; N-甲基-N-辛酰基-D-葡糖胺; N-辛酰基-N-甲基葡糖胺; Detergent Screening Solution 35/Fluka kit no 66317; MEGA-8 solution; MEGA-8 500 mM solution; MEGA-8; OMEGA; N-(D-Glucityl)-N-methyloctanamide; N-Methyl-N-octanoyl-D-glucamine; N-Octanoyl-N-methylglucamine

登记号

• CAS号: 85316-98-9
• MDL号: MFCD00134152
• Beilstein号: 5816747
• PubChem SID: 162232301; 24897973; 24864627
• PubChem CID: 160091

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

理化性质

• 溶解度: H2O: soluble50 mg/mL, clear, colorless
• 临界胶束浓度: 58; 58 mM(20-25°C)

安全信息

• 德国WGK号: 3
• 个人保护装置: Eyeshields, Gloves; Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
• 保存温度: 2-8°C

产品相关信息

• 纯度: ≥97%; ≥98.0% (TLC); 98%
• 简要说明: non-ionic
• 痕量阳离子: Ca: ≤10 mg/kg; Cd: ≤5 mg/kg; Co: ≤5 mg/kg; Cr: ≤5 mg/kg; Cu: ≤5 mg/kg; Fe: ≤5 mg/kg; K: ≤50 mg/kg; Mg: ≤5 mg/kg; Mn: ≤5 mg/kg; Na: ≤50 mg/kg; Ni: ≤5 mg/kg; Pb: ≤5 mg/kg; Zn: ≤5 mg/kg
• 产品线: BioXtra
• Empirical Formula (Hill Notation): C15H31NO6

详细说明

Sigma Aldrich - O3129

Application
Non-ionic detergent used for the solubilization of proteins

Sigma Aldrich - 74881

Other Notes
Water soluble detergent with high solubilising power and non-denaturating properties. Readily removed by dialysis.; Does not interfere with the monitoring of proteins at 280 nm1