Ethyl 5,6-dihydroxy-7-nitro-1-benzothiophene-2-carboxylate

Base Information

• Chemical Name: Ethyl 5,6-dihydroxy-7-nitro-1-benzothiophene-2-carboxylate
• CAS No.: 921197-25-3
• Molecular Formula: C11H9NO6S
• DSSTox Substance ID: DTXSID40580755
• Wikidata: Q82471691

Synonyms:921197-25-3;Ethyl 5,6-dihydroxy-7-nitro-1-benzothiophene-2-carboxylate;SCHEMBL1608920;DTXSID40580755

Chemical Property of Ethyl 5,6-dihydroxy-7-nitro-1-benzothiophene-2-carboxylate

Chemical Property:

• Vapor Pressure: 5.95E-09mmHg at 25°C
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 283.01505818
• Heavy Atom Count: 19
• Complexity: 373

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CC2=CC(=C(C(=C2S1)[N+](=O)[O-])O)O

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