1H-Imidazole-5-carboxylic acid
Properties
- Molecular formula
- C4H4N2O2
- Molar mass
- 112.09 g/mol
- Exact mass
- 112.0273 Da
- Melting point
- 275 °C
- logP
- 0.11Crippen estimate
- Polar surface area
- 66.0 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 1
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.7% of notifiers
Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
1072-84-0SMILES
O=C(O)c1cnc[nH]1InChIKey
NKWCGTOZTHZDHB-UHFFFAOYSA-NInChI
InChI=1S/C4H4N2O2/c7-4(8)3-1-5-2-6-3/h1-2H,(H,5,6)(H,7,8)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- Imidazole-4-carboxylic acid
- 1H-Imidazole-4-carboxylic acid
- Imidazole-4(or 5)-carboxylic acid
- 4-Carboxyimidazole
- Imidazole-5-carboxylic acid
- NSC 32340
- 1H-Imidazol-3-ium-4-carboxylate
Work with 1H-Imidazole-5-carboxylic acid
Similar compounds
1-(1H-Imidazol-4-yl)ethan-1-one61985-25-953 % similar
5-Pyrimidinecarboxylic acid4595-61-350 % similar
Methyl 1H-imidazole-5-carboxylate17325-26-748 % similar
4-Methylpyrrole-2-carboxylic acid18711-59-647 % similar
Pyrrole-2-carboxylic acid634-97-945 % similar
Ethyl imidazole-4-carboxylate23785-21-944 % similar
1H-Imidazole-5-acetic acid645-65-844 % similar
Pyrazole-3,5-dicarboxylic acid3112-31-044 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.