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| IUPAC Name: | 1H-benzimidazole |
| Description: | Benzimidazole (CAS# 51-17-2) is used as a reagent in the synthesis of Chalcone (C291855) derivatives which can exhibit antiplasmodial activity. Benzimidazole is also a reagent in the synthesis of quinazolines and quinazolinones which can be used as anti-inflammatory agents and PDE4B inhibitors. |
| Molecular Weight: | 118.14 |
| Molecular Formula: | C7H6N2 |
| Canonical SMILES: | C1=CC=C2C(=C1)NC=N2 |
| InChI: | InChI=1S/C7H6N2/c1-2-4-7-6(3-1)8-5-9-7/h1-5H,(H,8,9) |
| InChI Key: | HYZJCKYKOHLVJF-UHFFFAOYSA-N |
| Boiling Point: | 360 ℃ |
| Melting Point: | 338 to 342 °F |
| Purity: | 98.0% |
| Density: | 1.242 g/cm3 |
| Solubility: | >17.7 [ug/mL] (The mean of the results at pH 7.4) |
| Appearance: | Rhombic, Bipyramidal plates in water |
| Decomposition: | Dangerous; when heated to decomposition, It emits highly toxic fumes |
| MDL: | MFCD00005585 |
| LogP: | 1.56290 |
| pH: | Weak base |
| Stability: | High degree of chemical stability |
| Vapor Pressure: | 0.0000764 [mmHg] |
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