Butanoic acid, 4-(acetylamino)-, 3-(dimethoxyphosphinyl)propyl ester

Base Information

• Chemical Name: Butanoic acid, 4-(acetylamino)-, 3-(dimethoxyphosphinyl)propyl ester
• CAS No.: 132237-24-2
• Molecular Formula: C11H22NO6P
• Molecular Weight: 295.2692
• DSSTox Substance ID: DTXSID60157448
• Wikidata: Q83025588
• Mol file: 132237-24-2.mol

Synonyms:BRN 4752706;3-(Dimethoxyphosphinyl)propyl 4-(acetylamino)butanoate;Butanoic acid, 4-(acetylamino)-, 3-(dimethoxyphosphinyl)propyl ester;132237-24-2;DTXSID60157448;LS-46057

Chemical Property of Butanoic acid, 4-(acetylamino)-, 3-(dimethoxyphosphinyl)propyl ester

Chemical Property:

• Vapor Pressure: 5.22E-09mmHg at 25°C
• Boiling Point: 470.1°Cat760mmHg
• Flash Point: 238.1°C
• Density: 1.151g/cm³
• XLogP3: -0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 11
• Exact Mass: 295.11847442
• Heavy Atom Count: 19
• Complexity: 325

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NCCCC(=O)OCCCP(=O)(OC)OC

Technology Process of Butanoic acid, 4-(acetylamino)-, 3-(dimethoxyphosphinyl)propyl ester

There total 2 articles about Butanoic acid, 4-(acetylamino)-, 3-(dimethoxyphosphinyl)propyl ester 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: 96.8%

4-Acetylamino-butyric acid allyl ester (132237-21-9) + Dimethyl phosphite (868-85-9) → 4-Acetylamino-butyric acid 3-(dimethoxy-phosphoryl)-propyl ester (132237-24-2)

Guidance literature:

With di-tert-butyl peroxide; at 135 - 140 ℃; for 6h;

DOI:10.1007/BF00766546

Reference yield:

N-Acetyl-4-aminobutyric acid (3025-96-5) → 4-Acetylamino-butyric acid 3-(dimethoxy-phosphoryl)-propyl ester (132237-24-2)

Guidance literature:

Multi-step reaction with 2 steps

1: 1.) 15-crown-5, 90percent NaOH / 1.) CH₃CN, water, 20 deg C, 5 min, 2.) CH₃CN, water, 20-25 deg C, 8 h

2: 96.8 percent / di-tert-butylperoxide / 6 h / 135 - 140 °C

With sodium hydroxide; 15-crown-5; di-tert-butyl peroxide;

DOI:10.1007/BF00766546

upstream raw materials:

4-Acetylamino-butyric acid allyl ester

Dimethyl phosphite

N-Acetyl-4-aminobutyric acid

Refernces