6-Nitro-1-benzofuran-5-carboxylic acid

Base Information

• Chemical Name: 6-Nitro-1-benzofuran-5-carboxylic acid
• CAS No.: 342425-80-3
• Molecular Formula: C9H5 N O5
• Molecular Weight: 207.1397
• DSSTox Substance ID: DTXSID70494710
• Wikidata: Q82342281
• Mol file: 342425-80-3.mol

Synonyms:342425-80-3;6-Nitro-1-benzofuran-5-carboxylic acid;5-benzo[b]furancarboxylic acid,6-nitro-;DTXSID70494710;6-Nitrobenzofuran-5-carboxylic acid

Chemical Property of 6-Nitro-1-benzofuran-5-carboxylic acid

Chemical Property:

• PSA: 96.26000
• LogP: 2.56240
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 207.01677226
• Heavy Atom Count: 15
• Complexity: 287

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=COC2=CC(=C(C=C21)C(=O)O)[N+](=O)[O-]