Dimethyl 2-butyl-1H-imidazole-4,5-dicarboxylate

Base Information

• Chemical Name: Dimethyl 2-butyl-1H-imidazole-4,5-dicarboxylate
• CAS No.: 76100-28-2
• Molecular Formula: C11H16N2O4
• Molecular Weight: 240.259
• DSSTox Substance ID: DTXSID50566045
• Wikidata: Q82451472

Synonyms:Dimethyl 2-butyl-1H-imidazole-4,5-dicarboxylate;76100-28-2;SCHEMBL7303318;DTXSID50566045;XODOWGJPVFJPEU-UHFFFAOYSA-N;dimethyl 2-butylimidazole-4,5-dicarboxylate;Dimethyl 2-butylimidazol-4,5-dicarboxylic acid;2-n-butyl-1H-imidazole-4,5-dicarboxylic acid, dimethyl ester

Chemical Property of Dimethyl 2-butyl-1H-imidazole-4,5-dicarboxylate

Chemical Property:

• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 240.11100700
• Heavy Atom Count: 17
• Complexity: 283

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MSDS Files:

Useful:

• Canonical SMILES: CCCCC1=NC(=C(N1)C(=O)OC)C(=O)OC

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