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| | 2-Bromo-3-trifluoromethylpyridine Basic information |
| | 2-Bromo-3-trifluoromethylpyridine Chemical Properties |
| Melting point | 37-41 °C | | Boiling point | 76°C 8mm | | density | 1.707±0.06 g/cm3(Predicted) | | Fp | 84 °F | | storage temp. | under inert gas (nitrogen or Argon) at 2-8°C | | Water Solubility | Insoluble in water | | form | powder to crystal | | pka | -1+-.0.10(Predicted) | | color | Light yellow to Brown | | InChI | InChI=1S/C6H3BrF3N/c7-5-4(6(8,9)10)2-1-3-11-5/h1-3H | | InChIKey | OFGSIPQYQUVVPL-UHFFFAOYSA-N | | SMILES | C1(Br)=NC=CC=C1C(F)(F)F | | CAS DataBase Reference | 175205-82-0(CAS DataBase Reference) |
| Hazard Codes | F,T,Xi | | Risk Statements | 11-25-37/38-41-36/37/38 | | Safety Statements | 26-36/37/39-45 | | RIDADR | UN 2926 4.1/PG 3 | | WGK Germany | 3 | | Hazard Note | Irritant | | HazardClass | 4.1 | | PackingGroup | II | | HS Code | 29333990 | | Storage Class | 4.1B - Flammable solid hazardous materials | | Hazard Classifications | Acute Tox. 2 Oral Eye Dam. 1 Flam. Sol. 2 Skin Irrit. 2 STOT SE 3 |
| | 2-Bromo-3-trifluoromethylpyridine Usage And Synthesis |
| Chemical Properties | Light yellow Cryst | | Uses | 2-Bromo-3-trifluoromethylpyridine serves as a substrate for iridium-catalyzed borylation at the 5-position and participates in copper-mediated cross-coupling with ethyl bromodifluoroacetate to yield homo-coupling biaryl products[1][2]. The compound is employed in control experiments to investigate safety hazards associated with its homo-coupling reaction[2]. | | References |
[1] Shahzadi, H. T., Fatima, S., Akhter, N., Alazmi, M., Nawaf, A., Said, K. B., AlGhadhban, A., Sulieman, A. M. E., Saleem, R. S. Z., & Chotana, G. A. (2022). Iridium-Catalyzed C–H Borylation of CF3-Substituted Pyridines. ACS Omega, 7 13, 11460–11472. https://doi.org/10.1021/acsomega.2c00773 [2] Yang, Q., Cabrera, P. J., Li, X., Sheng, M., & Wang, N. X. (2018). Safety Evaluation of the Copper-Mediated Cross-Coupling of 2-Bromopyridines with Ethyl Bromodifluoroacetate. Organic Process Research & Development, 22 10, 1441–1447. https://doi.org/10.1021/acs.oprd.8b00261
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| | 2-Bromo-3-trifluoromethylpyridine Preparation Products And Raw materials |
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