1H-Imidazole-4-carboxylic acid, 5-cyano-

Base Information

• Chemical Name: 1H-Imidazole-4-carboxylic acid, 5-cyano-
• CAS No.: 56745-98-3
• Molecular Formula: C5H3N3O2
• Molecular Weight: 137.098
• European Community (EC) Number: 871-997-5
• DSSTox Substance ID: DTXSID60472603
• Wikidata: Q82301594
• Mol file: 56745-98-3.mol

Synonyms:56745-98-3;4-cyano-1H-imidazole-5-carboxylic acid;1H-Imidazole-4-carboxylic acid, 5-cyano-;5-CYANO-1H-IMIDAZOLE-4-CARBOXYLIC ACID;DTXSID60472603;AKOS006355017;CS-0093697;FT-0749193;D75429;EN300-222039

Chemical Property of 1H-Imidazole-4-carboxylic acid, 5-cyano-

Chemical Property:

• XLogP3: 0
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 137.022526347
• Heavy Atom Count: 10
• Complexity: 194

Purity/Quality:

NLT 98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=NC(=C(N1)C(=O)O)C#N