N-Oxodecyl meglumine

Base Information

• Chemical Name: N-Oxodecyl meglumine
• CAS No.: 85261-20-7
• Molecular Formula: C₁₇H₃₅NO₆
• Molecular Weight: 349.468
• European Community (EC) Number: 617-695-7
• UNII: 9Q27ZA5M8G
• DSSTox Substance ID: DTXSID0075027
• Nikkaji Number: J580.219I
• Wikidata: Q27272887
• Mol file: 85261-20-7.mol

Synonyms:decanoyl-N-methylglucamide;MEGA-10

Chemical Property of N-Oxodecyl meglumine

Chemical Property:

• Appearance/Colour: white powder
• Vapor Pressure: 1.11E-16mmHg at 25°C
• Melting Point: 91-93 °C
• Refractive Index: 1.52
• Boiling Point: 595.8 °C at 760 mmHg
• Flash Point: 314.2 °C
• PSA: 121.46000
• Density: 1.155 g/cm³
• LogP: 0.02140
• Storage Temp.: 2-8°C
• Solubility.: H2O: 10 mg/mL at 20 °C, clear, colorless
• Water Solubility.: Soluble in methanol at 50mg/ml. Also soluble in water at 10mg/ml 20 °C
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 14
• Exact Mass: 349.24643784
• Heavy Atom Count: 24
• Complexity: 328

Purity/Quality:

98%, ^*data from raw suppliers

N-Decanoyl-N-methylglucamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn,Xi
• Hazard Codes: Xn,Xi
• Statements: 20/21/22-36/37/38
• Safety Statements: 22-24/25-37/39-36-26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCCCCCCC(=O)N(C)CC(C(C(C(CO)O)O)O)O
• Isomeric SMILES: CCCCCCCCCC(=O)N(C)C[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O
• Uses: Non-ionic detergent for solubilizing membrane proteins

Technology Process of N-Oxodecyl meglumine

There total 4 articles about N-Oxodecyl meglumine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 83.0%

1-decanoic acid (334-48-5) + 1-deoxy-1-(methylamino)-D-glucitol (6284-40-8,97780-33-1) → MEGA 10 (85261-20-7) + Decanoic acid (2R,3R,4R,5S)-2,3,4,5-tetrahydroxy-6-methylamino-hexyl ester + Decanoic acid (2R,3R,4R,5S)-6-(decanoyl-methyl-amino)-2,3,4,5-tetrahydroxy-hexyl ester

Guidance literature:

With Novozym; In various solvent(s); at 90 ℃; for 25h; under 375.03 Torr;

DOI:10.1016/S0040-4020(97)00181-6

Reference yield:

1-deoxy-1-(methylamino)-D-glucitol (6284-40-8,97780-33-1) + n-decanoyl chloride (112-13-0) → MEGA 10 (85261-20-7)

Guidance literature:

With sodium hydroxide; In water; at 20 ℃; for 2h;

Reference yield:

1-decanoic acid (334-48-5) + 1-deoxy-1-(methylamino)-D-glucitol (6284-40-8,97780-33-1) → MEGA 10 (85261-20-7)

Guidance literature:

With Rhizomucor miehei Lipase (Lipozyme); In hexane; for 130h;

DOI:10.1016/S0040-4020(97)00450-X

upstream raw materials:

1-decanoic acid

1-deoxy-1-(methylamino)-D-glucitol

n-decanoyl chloride

Refernces

• 1、 Maugard, Thierry,Remaud-Simeon, Magali,Petre, Dominique,Monsan, Pierre. "Enzymatic synthesis of glycamide surfactants by amidification reaction". . p. 5185 - 5194. Retrieved 1997.
• 2、 -. "Use Of N-Methyl-N-Acylglucamines As Solubilizers". Paragraph 0070. . Retrieved 2015/05/26.