1H-imidazole-1-carboxylic acid

Base Information

• Chemical Name: 1H-imidazole-1-carboxylic acid
• CAS No.: 58978-32-8
• Molecular Formula: C4H4 N2 O2
• Molecular Weight: 112.08676
• DSSTox Substance ID: DTXSID30388505
• Nikkaji Number: J308.583J
• Mol file: 58978-32-8.mol

Synonyms:1H-imidazole-1-carboxylic acid;68887-64-9;58978-32-8;imidazole-1-carboxylic acid;EINECS 261-537-6;imidazolium carboxylate;UNII-F75VS399FE;SCHEMBL173415;F75VS399FE;imidazole-4(5)-carboxylic acid;DTXSID30388505;OKRROXQXGNEUSS-UHFFFAOYSA-N;STL163920;AKOS005747176;BB 0262631;FT-0730357

Chemical Property of 1H-imidazole-1-carboxylic acid

Chemical Property:

• Vapor Pressure: 3.99E-05mmHg at 25°C
• Boiling Point: 337.8°C at 760 mmHg
• Flash Point: 158.1°C
• PSA: 55.12000
• Density: 1.43g/cm³
• LogP: 0.40920
• XLogP3: -0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 112.027277375
• Heavy Atom Count: 8
• Complexity: 104

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CN(C=N1)C(=O)O