AS 701

Base Information

• Chemical Name: AS 701
• CAS No.: 80712-94-3
• Molecular Formula: C₃₁H₆₂N₂O₆
• Molecular Weight: 558.843
• Mol file: 80712-94-3.mol

Synonyms:N,N'-diheptyl-5,5-dimethyl-N,N'-bis(3-oxapentyl)-3,7-dioxanonanediamide;N,N'-diheptyl-5,5-dimethyl-N,N'-di[3-(2-oxapentyl)]-3,7-dioxanonanediamide;N-(2-Ethoxy-ethyl)-2-(3-{[(2-ethoxy-ethyl)-heptyl-carbamoyl]-methoxy}-2,2-dimethyl-propoxy)-N-heptyl-acetamide;

Chemical Property of AS 701

Chemical Property:

• Vapor Pressure: 5.56E-16mmHg at 25°C
• Boiling Point: 634.1°Cat760mmHg
• Flash Point: 337.3°C
• PSA: 77.54000
• Density: 0.972g/cm³
• LogP: 5.71680

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of AS 701

There total 4 articles about AS 701 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: 68.0%

chloride of 5,5-dimethyl-3,7-dioxanonanedioic acid (65115-09-5) + N-(3-oxapentyl)heptylamine (93404-41-2) → N,N'-diheptyl-5,5-dimethyl-N,N'-di<3-(2-oxapentyl)>-3,7-dioxanonanediamide (80712-94-3)

Guidance literature:

With triethylamine; In dichloromethane; benzene; Ambient temperature; overnight;

DOI:10.1021/ac50001a040

Reference yield: 65.0%

2-Bromoethyl ethyl ether (592-55-2) + N,N'-diheptyl-5,5-dimethyl-3,7-dioxanonanediamide (85553-29-3) → N,N'-diheptyl-5,5-dimethyl-N,N'-di<3-(2-oxapentyl)>-3,7-dioxanonanediamide (80712-94-3)

Guidance literature:

With sodium hydride; In benzene; for 7h; Heating;

DOI:10.1021/ja00350a012

Reference yield:

1-Heptylamine (111-68-2) → N,N'-diheptyl-5,5-dimethyl-N,N'-di<3-(2-oxapentyl)>-3,7-dioxanonanediamide (80712-94-3)

Guidance literature:

Multi-step reaction with 3 steps

1: 91 percent / 10 h / Heating

2: 98 percent / LiAlH₄ / diethyl ether; benzene / 15 h / Heating

3: 68 percent / (C₂H₅)3N / benzene; CH₂Cl₂ / Ambient temperature; overnight

With lithium aluminium tetrahydride; triethylamine; In diethyl ether; dichloromethane; benzene;

DOI:10.1021/ac50001a040

upstream raw materials:

2-Bromoethyl ethyl ether

N,N'-diheptyl-5,5-dimethyl-3,7-dioxanonanediamide

chloride of 5,5-dimethyl-3,7-dioxanonanedioic acid

N-(3-oxapentyl)heptylamine