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| IUPAC Name: | methyl 3-(bromomethyl)benzoate |
| Description: | Methyl 3-(bromomethyl)benzoate (CAS# 1129-28-8) is an intermediate used to prepare chromen-4-ones as DNA-dependent protein kinase inhibitors. It is also used to synthesize benzoic acid derivatives as influenza neuraminidase inhibitors. |
| Molecular Weight: | 229.07 |
| Molecular Formula: | C9H9BrO2 |
| Canonical SMILES: | COC(=O)C1=CC(=CC=C1)CBr |
| InChI: | InChI=1S/C9H9BrO2/c1-12-9(11)8-4-2-3-7(5-8)6-10/h2-5H,6H2,1H3 |
| InChI Key: | YUHSMQQNPRLEEJ-UHFFFAOYSA-N |
| Boiling Point: | 115-135 °C (0.8 torr) |
| Melting Point: | 43-46 °C |
| Purity: | 95 % |
| Density: | 1.47 g/cm3 |
| Appearance: | White crystalline powder or crystals |
| Storage: | Keep in dark place, Sealed in dry, Room Temperature |
| MDL: | MFCD00051437 |
| LogP: | 2.36810 |
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Carbonyl Compounds
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
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