Diethyl 1,2-ethanediylbis(nitrocarbamate)

Base Information

• Chemical Name: Diethyl 1,2-ethanediylbis(nitrocarbamate)
• CAS No.: 2639-89-6
• Molecular Formula: C8H14 N4 O8
• Molecular Weight: 294.221
• NSC Number: 36244
• DSSTox Substance ID: DTXSID90284211
• Wikidata: Q82019065

Synonyms:2639-89-6;diethyl 1,2-ethanediylbis(nitrocarbamate);NSC36244;DTXSID90284211;NSC-36244

Chemical Property of Diethyl 1,2-ethanediylbis(nitrocarbamate)

Chemical Property:

• Vapor Pressure: 3.19E-07mmHg at 25°C
• Boiling Point: 418.8°Cat760mmHg
• Flash Point: 207.1°C
• Density: 1.417g/cm³
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 7
• Exact Mass: 294.08116342
• Heavy Atom Count: 20
• Complexity: 340

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)N(CCN(C(=O)OCC)[N+](=O)[O-])[N+](=O)[O-]

Technology Process of Diethyl 1,2-ethanediylbis(nitrocarbamate)

There total 3 articles about Diethyl 1,2-ethanediylbis(nitrocarbamate) 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: 98.0%

N,N'-ethanediyl-bis-carbamic acid diethyl ester (818-42-8) → N,N'-dinitro-N,N'-ethane-1,2-diylbis(carbamic acid) diethyl ester (2639-89-6)

Guidance literature:

With dinitrogen pentoxide; In carbon dioxide; at 0 - 5 ℃; for 0.5h; under 45004.5 - 60006 Torr; Time; liquid CO₂;

DOI:10.1016/j.mencom.2013.03.008

Reference yield:

→ N,N'-dinitro-N,N'-ethane-1,2-diylbis(carbamic acid) diethyl ester (2639-89-6)

Guidance literature:

With nitric acid;

Reference yield:

→ N,N'-dinitro-N,N'-ethane-1,2-diylbis(carbamic acid) diethyl ester (2639-89-6)

Guidance literature:

Ethylendiamin nach Bachmann et al., Am. Soc. 72 (1950) 3132;

DOI:10.1021/jo01288a008

upstream raw materials:

N,N'-ethanediyl-bis-carbamic acid diethyl ester

Downstream raw materials:

1,4-dinitro-1,4-diazabutane

ethanol

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