3,5-Diethyl-4-methyl-1H-pyrrole-2-carboxylic acid

Base Information

• Chemical Name: 3,5-Diethyl-4-methyl-1H-pyrrole-2-carboxylic acid
• CAS No.: 112452-36-5
• Molecular Formula: C10H15NO2
• DSSTox Substance ID: DTXSID50551158
• Wikidata: Q82430681

Synonyms:112452-36-5;3,5-Diethyl-4-methyl-1H-pyrrole-2-carboxylic acid;DTXSID50551158

Chemical Property of 3,5-Diethyl-4-methyl-1H-pyrrole-2-carboxylic acid

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 181.110278721
• Heavy Atom Count: 13
• Complexity: 193

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=C(NC(=C1C)CC)C(=O)O

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