3-Amino-4-cyano-5-phenylthiophene-2-carboxylic acid

Base Information

• Chemical Name: 3-Amino-4-cyano-5-phenylthiophene-2-carboxylic acid
• CAS No.: 79204-51-6
• Molecular Formula: C₁₂H₈N₂O₂S
• Molecular Weight: 244.274
• DSSTox Substance ID: DTXSID40525722
• Wikidata: Q82393525

Synonyms:3-Amino-4-cyano-5-phenylthiophene-2-carboxylic acid;79204-51-6;DTXSID40525722

Chemical Property of 3-Amino-4-cyano-5-phenylthiophene-2-carboxylic acid

Chemical Property:

• XLogP3: 2.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 244.03064868
• Heavy Atom Count: 17
• Complexity: 346

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=C(C(=C(S2)C(=O)O)N)C#N

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