1-Ethyl-4-methyl-1H-imidazole-5-carboxylic acid

Base Information

• Chemical Name: 1-Ethyl-4-methyl-1H-imidazole-5-carboxylic acid
• CAS No.: 78449-68-0
• Molecular Formula: C7H10 N2 O2
• Molecular Weight: 154.168
• DSSTox Substance ID: DTXSID20506852
• Wikidata: Q72475907
• Mol file: 78449-68-0.mol

Synonyms:78449-68-0;1-ETHYL-4-METHYL-1H-IMIDAZOLE-5-CARBOXYLIC ACID;3-ETHYL-5-METHYLIMIDAZOLE-4-CARBOXYLIC ACID;1H-Imidazole-5-carboxylicacid, 1-ethyl-4-methyl-;SCHEMBL7987138;DTXSID20506852

Chemical Property of 1-Ethyl-4-methyl-1H-imidazole-5-carboxylic acid

Chemical Property:

• PSA: 55.12000
• Density: 1.23
• LogP: 0.90960
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 154.074227566
• Heavy Atom Count: 11
• Complexity: 161

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN1C=NC(=C1C(=O)O)C

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