4,5,6-trimethoxy-7-nitro-3H-2-benzofuran-1-one

Base Information

• Chemical Name: 4,5,6-trimethoxy-7-nitro-3H-2-benzofuran-1-one
• CAS No.: 960-52-1
• Molecular Formula: C11H11NO7
• DSSTox Substance ID: DTXSID00352511
• Wikidata: Q82129694
• Mol file: 960-52-1.mol

Synonyms:4,5,6-trimethoxy-7-nitro-3H-2-benzofuran-1-one;960-52-1;4,5,6-trimethoxy-7-nitro-2-benzofuran-1(3H)-one;Oprea1_260635;DTXSID00352511;STK950850;AKOS002348703;AF-399/36428048

Chemical Property of 4,5,6-trimethoxy-7-nitro-3H-2-benzofuran-1-one

Chemical Property:

• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 269.05355169
• Heavy Atom Count: 19
• Complexity: 369

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C(=C(C2=C1COC2=O)[N+](=O)[O-])OC)OC