2-(Diethylamino)-3,6-dinitro-4H-1-benzopyran-4-one

Base Information

• Chemical Name: 2-(Diethylamino)-3,6-dinitro-4H-1-benzopyran-4-one
• CAS No.: 88753-70-2
• Molecular Formula: C13H13N3O6
• DSSTox Substance ID: DTXSID60525209
• Wikidata: Q82392630

Synonyms:2-(Diethylamino)-3,6-dinitro-4H-1-benzopyran-4-one;88753-70-2;2-(diethylamino)-3,6-dinitrochromen-4-one;DTXSID60525209;CHEBI:180600

Chemical Property of 2-(Diethylamino)-3,6-dinitro-4H-1-benzopyran-4-one

Chemical Property:

• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 307.08043514
• Heavy Atom Count: 22
• Complexity: 517

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)C1=C(C(=O)C2=C(O1)C=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

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