ChemicalBook--->CAS DataBase List--->22620-27-5

22620-27-5

22620-27-5 Structure

22620-27-5 Structure
IdentificationMore
[Name]

5-Chloronicotinic acid
[CAS]

22620-27-5
[Synonyms]

5-CHLORONICOTINIC ACID
5-CHLOROPYRIDINE-3-CARBOXYLIC ACID
AKOS BBS-00001378
IFLAB-BB F1957-0008
5-CHLORONICOTINIC ACID/5-CHLOROPYRIDINE-3-CARBOXYLIC ACID
5-CHLOROPYRIDINE-3-CARBOXYLIC ACID 98%
[Molecular Formula]

C6H4ClNO2
[MDL Number]

MFCD00128901
[Molecular Weight]

157.55
[MOL File]

22620-27-5.mol
Questions And AnswerBack Directory
[Preparation]

Ethyl 5-chloronicotinic acid (10.5 g) was added to an aqueous solution of 1N NaOH (84.9 mL). The resulting reaction mixture was reacted at room temperature for several hours, and then transferred to 60 degrees Celsius to continue the reaction for 1 hour. The pH of the reaction solution was adjusted to 4-5 with hydrochloric acid, and a precipitate was observed to form. The precipitate was filtered to obtain the product 5-chloronicotinic acid, which was a colorless solid with a yield of 6.9 g.
Chemical PropertiesBack Directory
[Melting point ]

169-171°C
[Boiling point ]

303.7±22.0 °C(Predicted)
[density ]

1.470±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

powder to crystal
[pka]

3.10±0.10(Predicted)
[color ]

White to Almost white
[InChI]

InChI=1S/C6H4ClNO2/c7-5-1-4(6(9)10)2-8-3-5/h1-3H,(H,9,10)
[InChIKey]

XYLPLVUYPAPCML-UHFFFAOYSA-N
[SMILES]

C1=NC=C(Cl)C=C1C(O)=O
[CAS DataBase Reference]

22620-27-5(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

22
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29333990
Hazard InformationBack Directory
[Chemical Properties]

Off white powder
[Uses]

5-Chloronicotinic Acid is used as reagent/reactant luminescence and hydrothermal preparation of cobalt/cadmium/lead chloronicotinate phenanthroline MOF.
Spectrum DetailBack Directory
[Spectrum Detail]

5-Chloronicotinic acid(22620-27-5)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

5-Chloronicotinic acid, 97%(22620-27-5)
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