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2-Chloro-3-(trifluoroMethoxy)pyridine

Product Name
2-Chloro-3-(trifluoroMethoxy)pyridine
CAS No.
1206980-39-3
Chemical Name
2-Chloro-3-(trifluoroMethoxy)pyridine
Synonyms
2-Chloro-3-(trifluoroMethoxy)pyridine;Pyridine, 2-chloro-3-(trifluoromethoxy)-
CBNumber
CB92640726
Molecular Formula
C6H3ClF3NO
Formula Weight
197.54
MOL File
1206980-39-3.mol
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2-Chloro-3-(trifluoroMethoxy)pyridine Property

Boiling point:
57-59 °C(Press: 14 Torr)
Density 
1.463±0.06 g/cm3(Predicted)
storage temp. 
under inert gas (nitrogen or Argon) at 2-8°C
pka
-1.84±0.10(Predicted)
Appearance
Colorless to light yellow Liquid
InChI
InChI=1S/C6H3ClF3NO/c7-5-4(2-1-3-11-5)12-6(8,9)10/h1-3H
InChIKey
VJUMNUANNCTDHC-UHFFFAOYSA-N
SMILES
C1(Cl)=NC=CC=C1OC(F)(F)F
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Safety

Hazard Codes 
T
Risk Statements 
25
Safety Statements 
45
RIDADR 
UN 2811 6.1 / PGIII
HS Code 
2933399990
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Danger
Hazard statements

H301Toxic if swalloed

Precautionary statements

P301+P310IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.

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N-Bromosuccinimide Price

Sigma-Aldrich
Product number
MNO000207
Product name
2-Chloro-3-(trifluoromethoxy)pyridine
Packaging
1g
Price
$332
Updated
2023/01/07
TRC
Product number
B419715
Product name
2-Chloro-3-(trifluoromethoxy)pyridine
Packaging
500mg
Price
$330
Updated
2021/12/16
AK Scientific
Product number
3600AA
Product name
2-Chloro-3-(trifluoromethoxy)pyridine
Packaging
5g
Price
$1517
Updated
2021/12/16
Apolloscientific
Product number
PC421032
Product name
2-Chloro-3-(trifluoromethoxy)pyridine
Packaging
500mg
Price
$155
Updated
2021/12/16
AK Scientific
Product number
3600AA
Product name
2-Chloro-3-(trifluoromethoxy)pyridine
Packaging
250mg
Price
$211
Updated
2021/12/16
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2-Chloro-3-(trifluoroMethoxy)pyridine Chemical Properties,Usage,Production

Synthesis

1221171-74-9

1206980-39-3

General procedure for the synthesis of 2-chloro-3-trichloromethoxypyridine (8) from 2-chloro-3-trichloromethoxypyridine (7, 32.9 g, 0.13 mol): 2-chloro-3-trichloromethoxypyridine (7) was added slowly and dropwise to a molten mixture of SbF3 (46.5 g, 0.26 mol, 2.0 equiv) and SbCl5 (5.8 g, 2.5 mL, 19.5 mmol, 0.15 equiv) in a molten mixture. The reaction mixture was stirred at 120°C for 7 h. The progress of the reaction was monitored by gas chromatography (GC) to confirm complete conversion of the feedstock and disappearance of the by-product OCF2Cl. Upon completion of the reaction, the mixture was cooled to 0°C and dissolved in dichloromethane (300 mL). Subsequently, the reaction was quenched with saturated aqueous sodium bicarbonate solution (300 mL) and potassium fluoride solution (20%, 150 mL), and the aqueous layer was extracted with dichloromethane (2 x 150 mL). The organic layers were combined, dried over anhydrous sodium sulfate, and the solvent was removed by distillation under reduced pressure. The crude product was purified by vacuum distillation to afford 2-chloro-3-trifluoromethoxypyridine (8, 14.9 g, 75.6 mmol, 60% yield) as a colorless oil with a boiling point of 57-59 °C/19 mbar.The structure of the product was confirmed by 1H NMR, 13C NMR and mass spectrometry (MS): 1H NMR (CDCl3, 300 MHz): δ = 8.37 ( dd, J = 4.7, 1.5 Hz, 1H), 7.68 (dt, J = 8.1, 1.5 Hz, 1H), 7.41 (dd, J = 8.1, 4.7 Hz, 1H); 13C NMR (CDCl3, 75 MHz): δ = 147.4, 144.9, 142.2, 130.8, 123.2, 120.2 (q, J = 260 Hz); MS (EI): m/z = 197 [M+], 162 [M+-Cl].

References

[1] Patent: WO2010/40461, 2010, A1. Location in patent: Page/Page column 20-21
[2] European Journal of Organic Chemistry, 2010, # 31, p. 6043 - 6066

2-Chloro-3-(trifluoroMethoxy)pyridine Preparation Products And Raw materials

Raw materials

Preparation Products

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2-Chloro-3-(trifluoroMethoxy)pyridine Suppliers

Cochemical Ltd.
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1206980-39-3, 2-Chloro-3-(trifluoroMethoxy)pyridineRelated Search:


  • 2-Chloro-3-(trifluoroMethoxy)pyridine
  • Pyridine, 2-chloro-3-(trifluoromethoxy)-
  • 1206980-39-3