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| IUPAC Name: | dimethyl 1H-imidazole-4,5-dicarboxylate |
| Description: | Dimethyl Imidazole-4,5-dicarboxylate (CAS# 3304-70-9) is an intermediate used to prepare hedgehog signaling pathway inhibitors as antitumor agents. It is also used to synthesize imidazo[4,5-e][1,3]diazepine-4,8-diones with anti-hepatitis B and C virus activities in vitro. |
| Molecular Weight: | 184.15 |
| Molecular Formula: | C7H8N2O4 |
| Canonical SMILES: | COC(=O)C1=C(N=CN1)C(=O)OC |
| InChI: | InChI=1S/C7H8N2O4/c1-12-6(10)4-5(7(11)13-2)9-3-8-4/h3H,1-2H3,(H,8,9) |
| InChI Key: | CUIWFAXEALIQJS-UHFFFAOYSA-N |
| Boiling Point: | 338.2 °C at 760 mmHg |
| Density: | 1.346 g/cm3 |
| Solubility: | >27.6 [ug/mL] (The mean of the results at pH 7.4) |
| MDL: | MFCD00051338 |
| LogP: | -0.01710 |
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1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
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