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 ℃ (0.8 torr) |
Melting Point: | 43-46 ℃ |
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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2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
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