ChemicalBook--->CAS DataBase List--->944900-06-5

944900-06-5

944900-06-5 Structure

944900-06-5 Structure
IdentificationBack Directory
[Name]

2-CHLORO-6-(TRIFLUOROMETHYL)NICOTINALDEHYDE
[CAS]

944900-06-5
[Synonyms]

2-CHLORO-6-(TRIFLUOROMETHYL)NICOTINALDEHYDE
2-CHLORO-6-TRIFLUOROMETHYL-PYRIDINE-3-CARBALDEHYDE
3-Pyridinecarboxaldehyde, 2-chloro-6-(trifluoromethyl)-
[Molecular Formula]

C7H3ClF3NO
[MDL Number]

MFCD09907845
[MOL File]

944900-06-5.mol
[Molecular Weight]

209.55
Chemical PropertiesBack Directory
[Boiling point ]

225.3±40.0 °C(Predicted)
[density ]

1.499±0.06 g/cm3(Predicted)
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[pka]

-5.80±0.10(Predicted)
[Appearance]

Colorless to light yellow Liquid
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302
[Precautionary statements ]

P280-P305+P351+P338
[HS Code ]

2933399990
Spectrum DetailBack Directory
[Spectrum Detail]

2-CHLORO-6-(TRIFLUOROMETHYL)NICOTINALDEHYDE(944900-06-5)1HNMR
2-CHLORO-6-(TRIFLUOROMETHYL)NICOTINALDEHYDE(944900-06-5)19FNMR
2-CHLORO-6-(TRIFLUOROMETHYL)NICOTINALDEHYDE(944900-06-5)FT-IR
Hazard InformationBack Directory
[Synthesis]

(2-chloro-6-(trifluoromethyl)pyridin-3-yl)methanol

917396-39-5

2-CHLORO-6-(TRIFLUOROMETHYL)NICOTINALDEHYDE

944900-06-5

General procedure for the synthesis of 2-chloro-6-(trifluoromethyl)nicotinaldehyde from (2-chloro-6-(trifluoromethyl)pyridin-3-yl)methanol: In a 100 mL round bottom flask, add (2-chloro-6-(trifluoromethyl)pyridin-3-yl)methanol (1.00 g, 4.73 mmol), dichloromethane (10 mL), PCC (2.04 g, 9.45 mmol. Aldrich) and silica gel (6.00 g). The reaction mixture was stirred at room temperature for 3 hours before being filtered through a pad of silica gel and washed with a 4:1 solvent mixture of ethyl acetate/hexane. The filtrate was concentrated under vacuum to give 2-chloro-6-(trifluoromethyl)nicotinaldehyde (0.805 g, 81% yield) as a colorless oil.1H NMR (CDCl3) δ 10.50 (s, 1H), 8.42 (d, J = 7.8 Hz, 1H), 7.80 (d, J = 7.8 Hz, 1H).

[References]

[1] Patent: WO2010/83246, 2010, A1. Location in patent: Page/Page column 105-106
[2] Patent: WO2013/64460, 2013, A1. Location in patent: Page/Page column 127
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