ChemicalBook--->CAS DataBase List--->66662-48-4

66662-48-4

66662-48-4 Structure

66662-48-4 Structure
IdentificationBack Directory
[Name]

2-Chloro-4,6-dimethyl-3-pyridinecarboxylic acid
[CAS]

66662-48-4
[Synonyms]

2-chloro-4,6-dimethylpyridine-3-carboxylicaci
2-CHLORO-4,6-DIMETHYL-3-PYRIDINECARBOXYLIC ACID
2-chloro-4,6-dimethylpyridine-3-carboxylic acid
3-Pyridinecarboxylic acid, 2-chloro-4,6-dimethyl-
2-Chloro-4,6-dimethyl-3-pyridinecarboxylic acid ISO 9001:2015 REACH
[Molecular Formula]

C8H8ClNO2
[MDL Number]

MFCD02110082
[MOL File]

66662-48-4.mol
[Molecular Weight]

185.61
Chemical PropertiesBack Directory
[Melting point ]

139-140 °C(Solv: ethyl acetate (141-78-6))
[Boiling point ]

342.3±37.0 °C(Predicted)
[density ]

1.328±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[pka]

2.11±0.38(Predicted)
[Appearance]

White to off-white Solid
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
[HS Code ]

2933399990
Spectrum DetailBack Directory
[Spectrum Detail]

2-Chloro-4,6-dimethyl-3-pyridinecarboxylic acid(66662-48-4)1HNMR
Hazard InformationBack Directory
[Synthesis]

2-Chloro-3-cyano-4,6-dimethylpyridine

14237-71-9

2-Chloro-4,6-dimethyl-3-pyridinecarboxylic acid

66662-48-4

Example C Synthesis of 2-chloro-4,6-dimethylnicotinic acid: 15 g of 2-chloro-3-cyano-4,6-dimethylpyridine [Jahine, J. prakt. Chem. 316, 337 (1974)] was mixed with 40 ml of concentrated sulphuric acid and 13 ml of fuming nitric acid, and heated with stirring to 95° C to initiate an exothermic reaction. The reaction temperature was maintained between 95 °C and 100 °C by cooling with ice water. After the exothermic reaction subsided, stirring was continued at 100°C for 30 minutes. Subsequently, the reaction mixture was decanted into ice and the pH was adjusted with ammonia to 3-4. The precipitate was collected by filtration and washed with water. The resulting solid was dehydrated by azeotropy with toluene in a device fitted with a water trap and finally recrystallized by toluene to give the target compound in 80% yield of the theoretical value with a melting point of 159-160°C. The results of elemental analysis were as follows: molecular formula C8H8ClNO2, molecular weight 185.6; calculated values: C 51.77%, H 4.34%, Cl 19.10%, N 7.55%; measured values: C 51.85%, H 4.36%, Cl 19.25%, N 7.56%.

[References]

[1] Patent: US4167570, 1979, A
[2] Chemistry of Heterocyclic Compounds, 2004, vol. 40, # 3, p. 308 - 314
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