3-Acetamido-6-nitrochromen-2-one

Base Information

• Chemical Name: 3-Acetamido-6-nitrochromen-2-one
• CAS No.: 787-63-3
• Molecular Formula: C11H8N2O5
• DSSTox Substance ID: DTXSID10352724
• Nikkaji Number: J2.476.701I
• Wikidata: Q82130018
• Mol file: 787-63-3.mol

Synonyms:787-63-3;3-Acetamido-6-nitrochromen-2-one;N-(6-Nitro-2-oxo-2H-chromen-3-yl)acetamide;Maybridge1_000929;3-acetamido-6-nitrocoumarin;Oprea1_279321;Oprea1_792519;acetamide,n-(6-nitro-2-oxo-2h-1-benzopyran-3-yl)-;SCHEMBL3278394;HMS544C05;DTXSID10352724;XFJUNGZIABENHT-UHFFFAOYSA-N;AKOS000639132;CCG-234626

Chemical Property of 3-Acetamido-6-nitrochromen-2-one

Chemical Property:

• XLogP3: 1.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 248.04332136
• Heavy Atom Count: 18
• Complexity: 426

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)NC1=CC2=C(C=CC(=C2)[N+](=O)[O-])OC1=O