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| IUPAC Name: | 4-bromo-1-chloro-2-[(4-ethoxyphenyl)methyl]benzene |
| Description: | 4-bromo-1-chloro-2-(4-ethoxybenzyl)benzene is an impurity of Dapagliflozin. Dapagliflozin is a selective, orally active inhibitor of the renal sodium-glucose co-transporter type 2 (SGLT2) in development for the treatment of type 2 diabetes mellitus (T2DM). |
| Molecular Weight: | 325.63 |
| Molecular Formula: | C15H14BrClO |
| Canonical SMILES: | CCOC1=CC=C(C=C1)CC2=C(C=CC(=C2)Br)Cl |
| InChI: | InChI=1S/C15H14BrClO/c1-2-18-14-6-3-11(4-7-14)9-12-10-13(16)5-8-15(12)17/h3-8,10H,2,9H2,1H3 |
| InChI Key: | ZUNCHZBITMUSRD-UHFFFAOYSA-N |
| Boiling Point: | 393.0±32.0 °C at 760 mmHg |
| Melting Point: | 41-43°C |
| Density: | 1.4±0.1 g/cm3 |
| Solubility: | Soluble in Acetonitrile, DMSO, Methanol |
| Appearance: | White to Off-white Low-Melting Solid |
| Storage: | Store at -20°C |
| MDL: | MFCD11042292 |
| LogP: | 5.09200 |
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Halides
1-(4-Bromo-2-ethylpyrazol-3-yl)-N-methylmethanamine hydrochloride
1-{4-[3-(Trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanamine hydrochloride
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