Diphenyl (N-Methoxy-N-methylcarbamoylmethyl)phosphonate

Base Information

• Chemical Name: Diphenyl (N-Methoxy-N-methylcarbamoylmethyl)phosphonate
• CAS No.: 367508-01-8
• Molecular Formula: C16H18 N O5 P
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID00476140
• Wikidata: Q82307127
• Mol file: 367508-01-8.mol

Synonyms:367508-01-8;Diphenyl (N-Methoxy-N-methylcarbamoylmethyl)phosphonate;2-diphenoxyphosphoryl-N-methoxy-N-methylacetamide;Diphenyl (2-(methoxy(methyl)amino)-2-oxoethyl)phosphonate;(N-Methoxy-N-methylcarbamoylmethyl)phosphonic Acid Diphenyl Ester;SCHEMBL3626452;DTXSID00476140;MFCD30186043;D3709;A913648;Diphenyl(2-(methoxy(methyl)amino)-2-oxoethyl)phosphonate

Chemical Property of Diphenyl (N-Methoxy-N-methylcarbamoylmethyl)phosphonate

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.555
• Boiling Point: 430.708°C at 760 mmHg
• Flash Point: 214.284°C
• PSA: 84.11000
• Density: 1.259g/cm³
• LogP: 3.92480
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 335.09225967
• Heavy Atom Count: 23
• Complexity: 395

Purity/Quality:

98% ^*data from raw suppliers

Diphenyl (N-Methoxy-N-methylcarbamoylmethyl)phosphonate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C(=O)CP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2)OC

Technology Process of Diphenyl (N-Methoxy-N-methylcarbamoylmethyl)phosphonate

There total 2 articles about Diphenyl (N-Methoxy-N-methylcarbamoylmethyl)phosphonate 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: 61.0%

2-chloro-N-methoxy-N-methylacetamide (67442-07-3) + diphenyl hydrogen phosphite (4712-55-4) → diethyl (N-methoxy-N-methylcarbamoylmethyl)phosphonate (367508-01-8)

Guidance literature:

diphenyl hydrogen phosphite; With sodium hydride; In tetrahydrofuran; at 0 ℃; for 0.5h;

2-chloro-N-methoxy-N-methylacetamide; In tetrahydrofuran; at 0 - 20 ℃;

DOI:10.1002/hc.20054

Reference yield:

diphenyl hydrogen phosphite (4712-55-4) + 2-bromo-N-methoxy-N-methyl-acetamide (134833-83-3) → diethyl (N-methoxy-N-methylcarbamoylmethyl)phosphonate (367508-01-8)

Guidance literature:

With triethylamine; In dichloromethane;

DOI:10.1055/s-2001-16072

Reference yield: 93.0%

2-azidobenzaldehyde (16714-25-3) + diethyl (N-methoxy-N-methylcarbamoylmethyl)phosphonate (367508-01-8) → C11H12N4O2

Guidance literature:

diethyl (N-methoxy-N-methylcarbamoylmethyl)phosphonate; With sodium hydride; In tetrahydrofuran; at 0 ℃; for 0.5h; Inert atmosphere;

2-azidobenzaldehyde; In tetrahydrofuran; at -10 - 20 ℃; for 2.53333h; Inert atmosphere;

DOI:10.1021/ja111060q

upstream raw materials:

diphenyl hydrogen phosphite

2-bromo-N-methoxy-N-methyl-acetamide

2-chloro-N-methoxy-N-methylacetamide

Downstream raw materials:

N-methoxy-N-methylcinnamamide

(2Z)-N-methoxy-N-methyl-3-phenyl-2-propenamide

(E)-N-methoxy-N-methyl-5-phenyl-2-pentenamide

(Z)-N-methoxy-N-methyl-5-phenyl-2-pentenamide

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