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| IUPAC Name: | 1-bromo-2,4,5-trichlorobenzene |
| Description: | 1-Bromo-2,4,5-trichlorobenzene (CAS# 29682-44-8) is used as a reagent in the synthesis of pyrrolnitrin analogs used for the design of agricultural fungicides. It also used as a reagent in the synthesis of dioxin-like monofluorinated polychlorinated biphenyls (PCBs) for the use as internal standards in PCB analysis. |
| Molecular Weight: | 260.34 |
| Molecular Formula: | C6H2BrCl3 |
| Canonical SMILES: | C1=C(C(=CC(=C1Cl)Br)Cl)Cl |
| InChI: | InChI=1S/C6H2BrCl3/c7-3-1-5(9)6(10)2-4(3)8/h1-2H |
| InChI Key: | PHDKZIIWDGIUCG-UHFFFAOYSA-N |
| Boiling Point: | 268.9 ℃ at 760 mmHg |
| Density: | 1.84 g/cm3 |
| MDL: | MFCD00155012 |
| LogP: | 4.40930 |
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