ChemicalBook--->CAS DataBase List--->39890-95-4

39890-95-4

39890-95-4 Structure

39890-95-4 Structure
IdentificationMore
[Name]

2-Chloro-6-(trifluoromethyl)pyridine
[CAS]

39890-95-4
[Synonyms]

2-CHLORO-6-(TRIFLUOROMETHYL)PYRIDINE
BUTTPARK 27\08-82
PYRIDINE, 2-CHLORO-6-(TRIFLUOROMETHYL)-
6-Chloro-2-(trifluoromethyl)pyridine
2-CHLORO-6-TRIFLUOROMETHYLPRIDINE
2-Chloro-5-trifluoromethylpyri
2-CHLORO-6-TRIFLUOROMETHYL-PYRIDINE >97%
[EINECS(EC#)]

624-440-3
[Molecular Formula]

C6H3ClF3N
[MDL Number]

MFCD00042226
[Molecular Weight]

181.54
[MOL File]

39890-95-4.mol
Chemical PropertiesBack Directory
[Appearance]

Colorless to off-white liquid (or White to off-white crystal)
[Melting point ]

33 °C
[Boiling point ]

60-62°C 8mm
[density ]

1.416±0.06 g/cm3(Predicted)
[Fp ]

78°C
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[Water Solubility ]

Insoluble in water
[form ]

powder to lump
[pka]

-4.30±0.10(Predicted)
[color ]

White to Almost white
[FreezingPoint ]

32.0 to 34.0 ℃
[BRN ]

4308910
[InChI]

InChI=1S/C6H3ClF3N/c7-5-3-1-2-4(11-5)6(8,9)10/h1-3H
[InChIKey]

ADVQMCQMDHBTHJ-UHFFFAOYSA-N
[SMILES]

C1(Cl)=NC(C(F)(F)F)=CC=C1
[CAS DataBase Reference]

39890-95-4(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)
GHS06
[Signal word ]

Danger
[Hazard statements ]

H300-H319
[Precautionary statements ]

P264-P270-P280-P301+P310-P305+P351+P338-P337+P313
[Hazard Codes ]

T;Xn,Xi,Xn,T
[Risk Statements ]

R25:Toxic if swallowed.
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
R36:Irritating to the eyes.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36/37:Wear suitable protective clothing and gloves .
S9:Keep container in a well-ventilated place .
S36:Wear suitable protective clothing .
[RIDADR ]

2811
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29333990
[Storage Class]

6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
[Hazard Classifications]

Acute Tox. 2 Oral
Eye Irrit. 2
Hazard InformationBack Directory
[Chemical Properties]

Colorless to off-white liquid (or White to off-white crystal)
[Uses]

2-Chloro-6-(trifluoromethyl)pyridine can be used in the synthesis of medicine, pesticide or biocidal product.
[Chemical Reactivity]

2-Chloro-6-(trifluoromethyl)pyridine is stable under recommended storage conditions, it reacts with strong oxidizing agents, strong acids, strong bases.
[Synthesis]

Nitrapyrin

1929-82-4

2-Chloro-6-(trifluoromethyl)pyridine

39890-95-4

General procedure for the synthesis of 2-chloro-6-trichloromethylpyridine from 2-chloro-6-trichloromethylpyridine: 2-chloro-6-trichloromethylpyridine (700 g, 3.03 mol, feed rate 1.24 g/min) and anhydrous hydrogen fluoride (936 g, 46.8 mol, feed rate 1.66 g/min) were added successively to a tubular reactor fitted with a preactivated chromium oxide-alumina catalyst (210 g) in a tubular reactor at a reaction temperature of 330 °C. The reaction products were cooled with ice water and collected. The reaction products were collected after cooling with ice water and extracted with dichloromethane. The extract was washed with 10% potassium hydroxide solution, and the organic layer was separated and concentrated to give 490.0 g of crude 2-chloro-6-trifluoromethylpyridine, which was analyzed by GC for 95.03% purity and 89% reaction yield. The crude product was purified by fractionation to obtain 2-chloro-6-trifluoromethylpyridine with 98.0% purity and 80.0% yield.

[References]

[1] Patent: WO2016/178248, 2016, A1. Location in patent: Page/Page column 5
Spectrum DetailBack Directory
[Spectrum Detail]

2-Chloro-6-(trifluoromethyl)pyridine(39890-95-4)MS
2-Chloro-6-(trifluoromethyl)pyridine(39890-95-4)1HNMR
2-Chloro-6-(trifluoromethyl)pyridine(39890-95-4)13CNMR
2-Chloro-6-(trifluoromethyl)pyridine(39890-95-4)IR1
2-Chloro-6-(trifluoromethyl)pyridine(39890-95-4)IR2
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2-chloro-6-(trifluoromethyl)pyridine(39890-95-4)
[Alfa Aesar]

2-Chloro-6-(trifluoromethyl)pyridine, 97%(39890-95-4)
[Sigma Aldrich]

39890-95-4(sigmaaldrich)
[TCI AMERICA]

2-Chloro-6-(trifluoromethyl)pyridine,>98.0%(GC)(39890-95-4)
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