303727-31-3
| Name | 2-(Phenyl)-4-(3-hydroxy-4-chlorophenyl)-5-(4-pyridyl)-1H-imidazole |
| CAS | 303727-31-3 |
| Molecular Formula | C20H14ClN3O |
| MDL Number | MFCD12828750 |
| Molecular Weight | 347.8 |
| MOL File | 303727-31-3.mol |
Chemical Properties
| Boiling point | 579.8±50.0 °C(Predicted) |
| density | 1.335±0.06 g/cm3(Predicted) |
| storage temp. | Sealed in dry,2-8°C |
| solubility | DMSO:44.67(Max Conc. mg/mL);128.44(Max Conc. mM) DMF:30.0(Max Conc. mg/mL);86.26(Max Conc. mM) DMF:PBS (pH 7.2) (1:7):0.12(Max Conc. mg/mL);0.35(Max Conc. mM) Ethanol:2.0(Max Conc. mg/mL);5.75(Max Conc. mM) |
| form | Powder |
| pka | 8.09±0.10(Predicted) |
| color | Light yellow to yellow |
| InChI | 1S/C20H14ClN3O/c21-16-7-6-15(12-17(16)25)19-18(13-8-10-22-11-9-13)23-20(24-19)14-4-2-1-3-5-14/h1-12,25H,(H,23,24) |
| InChIKey | WXJLXRNWMLWVFB-UHFFFAOYSA-N |
| SMILES | ClC(C(O)=C1)=CC=C1C(N=C(C2=CC=CC=C2)N3)=C3C4=CC=NC=C4 |
Safety Data
| Symbol(GHS) |  GHS06 |
| Signal word | Danger |
| Hazard statements | H301-H315-H319-H335 |
| Precautionary statements | P280-P301+P310+P330-P304+P340+P312-P305+P351+P338-P337+P313 |
| WGK Germany | WGK 3 |
| HS Code | 2933399990 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |