Agn-PC-04fgn1

Base Information

• Chemical Name: Agn-PC-04fgn1
• CAS No.: 62285-43-2
• Molecular Formula: C9H21N2O6P2+
• Molecular Weight: 315.2198
• NSC Number: 307460
• DSSTox Substance ID: DTXSID30400812
• Mol file: 62285-43-2.mol

Synonyms:62285-43-2;AGN-PC-04FGN1;DTXSID30400812;NSC307460;NSC-307460

Chemical Property of Agn-PC-04fgn1

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: g/cm³
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 8
• Exact Mass: 314.07966036
• Heavy Atom Count: 19
• Complexity: 422

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)OP(=O)(C(=[N+]=[N-])P(=O)(OC)OC)OC(C)C

Technology Process of Agn-PC-04fgn1

There total 2 articles about Agn-PC-04fgn1 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: 82.0%

dimethyl <methyl>phosphonate (62285-41-0) → dimethyl <diazomethyl>phosphonate (62285-43-2)

Guidance literature:

With 4-toluenesulfonyl azide; potassium hydride; In tetrahydrofuran; hexane; at 21 ℃; for 0.5h;

DOI:10.1021/jo00346a025

Reference yield:

diisopropyl methyl phosphate (26955-63-5,129149-78-6) → dimethyl <diazomethyl>phosphonate (62285-43-2)

Guidance literature:

Multi-step reaction with 2 steps

1: 71 percent / n-butyllithium / tetrahydrofuran / -75 °C

2: 82 percent / potassium hydride, p-toluenesulfonyl azide / hexane; tetrahydrofuran / 0.5 h / 21 °C

With n-butyllithium; 4-toluenesulfonyl azide; potassium hydride; In tetrahydrofuran; hexane;

DOI:10.1021/jo00346a025

upstream raw materials:

dimethyl <methyl>phosphonate

diisopropyl methyl phosphate