5,6-Dihydroxy-7-nitro-2-benzofuran-1(3H)-one

Base Information

• Chemical Name: 5,6-Dihydroxy-7-nitro-2-benzofuran-1(3H)-one
• CAS No.: 921196-79-4
• Molecular Formula: C8H5NO6
• DSSTox Substance ID: DTXSID90580720
• Wikidata: Q82471636
• Mol file: 921196-79-4.mol

Synonyms:921196-79-4;5,6-Dihydroxy-7-nitro-2-benzofuran-1(3H)-one;SCHEMBL1608810;DTXSID90580720;INRDBACIAURJJN-UHFFFAOYSA-N;5,6-Dihydroxy-7-nitro-3H-isobenzofuran-1-one

Chemical Property of 5,6-Dihydroxy-7-nitro-2-benzofuran-1(3H)-one

Chemical Property:

• XLogP3: 1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 0
• Exact Mass: 211.01168688
• Heavy Atom Count: 15
• Complexity: 300

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C2=CC(=C(C(=C2C(=O)O1)[N+](=O)[O-])O)O