2,3-Dihydro-1-methyl-2-thioxo-1H-benzimidazole-5-carboxylic acid

Base Information

• Chemical Name: 2,3-Dihydro-1-methyl-2-thioxo-1H-benzimidazole-5-carboxylic acid
• CAS No.: 100440-61-7
• Molecular Formula: C₉H₈N₂O₂S
• Molecular Weight: 208.241
• DSSTox Substance ID: DTXSID801170840

Synonyms:DTXSID801170840;2,3-Dihydro-1-methyl-2-thioxo-1H-benzimidazole-5-carboxylic acid;100440-61-7

Chemical Property of 2,3-Dihydro-1-methyl-2-thioxo-1H-benzimidazole-5-carboxylic acid

Chemical Property:

• XLogP3: 0.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 208.03064868
• Heavy Atom Count: 14
• Complexity: 282

Purity/Quality:

2,3-dihydro-1-methyl-2-thioxo-1H-Benzimidazole-5-carboxylicacid 97.00% ^*data from reagent suppliers

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CN1C2=C(C=C(C=C2)C(=O)O)NC1=S

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