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88912-24-7

88912-24-7 Structure

88912-24-7 Structure
IdentificationBack Directory
[Name]

2-Pyridinecarboxylic acid, 5,6-dichloro-
[CAS]

88912-24-7
[Synonyms]

5,6-dichloropicolinic acid
2,3Dichloro6carboxypyridine
5,6-Dichloropicolinic acid 98%
5,6-Dichloro-2-pyridinecarboxylicacid
5,6-Dichloropyridine-2-carboxylic acid
2-Pyridinecarboxylic acid, 5,6-dichloro-
5,6-Dichloropyridine-2-carboxylicacid,98%
5,6-Dichloro-2-pyridinecarboxylic acid 5,6dichloropicolinic acid
[EINECS(EC#)]

-0
[Molecular Formula]

C6H3Cl2NO2
[MDL Number]

MFCD13185546
[MOL File]

88912-24-7.mol
[Molecular Weight]

192
Chemical PropertiesBack Directory
[Boiling point ]

342.1±37.0 °C(Predicted)
[density ]

1.612±0.06 g/cm3(Predicted)
[storage temp. ]

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

Solid
[pka]

3.04±0.10(Predicted)
[Appearance]

White to off-white Solid
[InChI]

InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(6(10)11)9-5(3)8/h1-2H,(H,10,11)
[InChIKey]

QOJNAEPFSUYAFL-UHFFFAOYSA-N
[SMILES]

C1(C(O)=O)=NC(Cl)=C(Cl)C=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P280a-P304+P340-P305+P351+P338-P405-P501a
[HS Code ]

2933399990
Hazard InformationBack Directory
[Uses]

2-Pyridinecarboxylic acid, 5,6-dichlorois known for its role in the synthesis of pharmaceuticals and agrochemicals, as well as its utility as a building block in organic synthesis and a reagent in various chemical reactions.
[Synthesis]

2-Pyridinecarboxylic acid, 5-chloro-, 1-oxide

1415898-80-4

2-Pyridinecarboxylic acid, 5,6-dichloro-

88912-24-7

5-Chloro-1-yloxy-pyridine-2-carboxylic acid (CAS: 1415898-80-4, 1.2 g, 7 mmol) was used as a raw material and was slowly added to phosphorus trichloride (POCl3, 10 g) at 0 °C. The reaction mixture was warmed up to 95 °C and maintained at this temperature for 1 hour. After completion of the reaction, the mixture was concentrated to dryness under reduced pressure. The residue was dissolved in water (15 mL) and extracted with ethyl acetate (2 × 15 mL). The organic phases were combined and washed sequentially with water (2 × 30 mL) and saturated saline (30 mL). The organic phase was dried over anhydrous sodium sulfate and concentrated under reduced pressure to afford 5,6-dichloro-2-pyridinecarboxylic acid (1 g, 75% yield) as a yellow solid. The product was confirmed by mass spectrometry (EI), m/e = 191.9 [M + H]+.

[References]

[1] Patent: US2012/316147, 2012, A1. Location in patent: Page/Page column 66
[2] Patent: WO2012/168350, 2012, A1. Location in patent: Page/Page column 140
Spectrum DetailBack Directory
[Spectrum Detail]

2-Pyridinecarboxylic acid, 5,6-dichloro-(88912-24-7)1HNMR
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