Ethoxycarbonylformonitrile oxide

Base Information

• Chemical Name: Ethoxycarbonylformonitrile oxide
• CAS No.: 51983-62-1
• Molecular Formula: C4H5NO3
• Molecular Weight: 115.08700
• DSSTox Substance ID: DTXSID00455652
• Nikkaji Number: J354.238F,J3.620.206H
• Mol file: 51983-62-1.mol

Synonyms:Ethoxycarbonylformonitrile oxide;51983-62-1;Ethoxyoxoacetonitrileoxide;Carbonocyanidic acid, ethyl ester, N-oxide;ethyl cyanoformate n-oxide;SCHEMBL7973007;DTXSID00455652;Ethoxycarbonyl(oxylatoimino)methylium;J3.620.206H

Chemical Property of Ethoxycarbonylformonitrile oxide

Chemical Property:

• PSA: 49.36000
• LogP: -0.20190
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 115.026943022
• Heavy Atom Count: 8
• Complexity: 140

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

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

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