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2-Bromo-3-trifluoromethylpyridine

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2-Bromo-3-trifluoromethylpyridine manufacturers

2-Bromo-3-trifluoromethylpyridine Basic information
Product Name:2-Bromo-3-trifluoromethylpyridine
Synonyms:2-Bromo-3-trifluoromethylpyridine 2-Bromo-3-(trifluoromethyl)pyridine;BUTTPARK 27\06-85;PYRIDINE, 2-BROMO-3-(TRIFLUOROMETHYL)-;2-Bromo-3-(trifluoromethyl)pyridine 98%;2-Bromo-3-(trifluoromethyl)pyridine98%;16189;Bromotrifluoromethylpyridine 23()---;2-Bromo-alpha,alpha,alpha-trifluoro-3-picoline
CAS:175205-82-0
MF:C6H3BrF3N
MW:225.99
EINECS:
Product Categories:Halides;Pyridine;Building Blocks;C5 to C6;C6 to C7;Chemical Synthesis;Halogenated Heterocycles;Heterocyclic Building Blocks;Fluorine series;Halogenated;Organohalides;Bromopyridines;Halopyridines;C6Heterocyclic Building Blocks;Halogenated Heterocycles;Heterocyclic Building Blocks;blocks;Bromides;FluoroCompounds;Pyridines
Mol File:175205-82-0.mol
2-Bromo-3-trifluoromethylpyridine Structure
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
InChIInChI=1S/C6H3BrF3N/c7-5-4(6(8,9)10)2-1-3-11-5/h1-3H
InChIKeyOFGSIPQYQUVVPL-UHFFFAOYSA-N
SMILESC1(Br)=NC=CC=C1C(F)(F)F
CAS DataBase Reference175205-82-0(CAS DataBase Reference)
Safety Information
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 Class4.1B - Flammable solid hazardous materials
Hazard ClassificationsAcute Tox. 2 Oral
Eye Dam. 1
Flam. Sol. 2
Skin Irrit. 2
STOT SE 3
MSDS Information
ProviderLanguage
SigmaAldrich English
2-Bromo-3-trifluoromethylpyridine Usage And Synthesis
Chemical PropertiesLight yellow Cryst
Uses2-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
2-Bromo-3-trifluoromethylpyridine Preparation Products And Raw materials
Preparation Products3-(Trifluoromethyl)pyridine-2-carboxylic acid
Tag:2-Bromo-3-trifluoromethylpyridine(175205-82-0) Related Product Information
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