ChemicalBook--->CAS DataBase List--->1077-95-8

1077-95-8

1077-95-8 Structure

1077-95-8 Structure
IdentificationBack Directory
[Name]

5-CHLORO-1H-INDAZOLE-3-CARBOXYLIC ACID
[CAS]

1077-95-8
[Synonyms]

5-CHLORO-3-INDAZOLECARBOXYLIC ACID
5-CHLORO-3-INDOZOLE-CARBOXYLIC ACID
5-chloro-1H-indazol-3-carboxylic acid
5-chloro-1h-indazole-3-carboxylic acod
5-CHLORO-1H-INDAZOLE-3-CARBOXYLIC ACID
5-CHLORO-3-(1H)INDAZOLE CARBOXYLIC ACID
1H-Indazole-3-carboxylic acid, 5-chloro-
5-Chloro-1H-indazole-3-carboxylic acid ,97%
[Molecular Formula]

C8H5ClN2O2
[MDL Number]

MFCD02326712
[MOL File]

1077-95-8.mol
[Molecular Weight]

196.59
Chemical PropertiesBack Directory
[Melting point ]

337 °C
[Boiling point ]

472.1±25.0 °C(Predicted)
[density ]

1.644±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[form ]

solid
[pka]

2.82±0.30(Predicted)
[color ]

Yellow
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319
[Precautionary statements ]

P305+P351+P338
[Risk Statements ]

22-36
[Safety Statements ]

26
[HS Code ]

29339900
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Sodium hydroxide
[Preparation Products]

Methyl 5-chloro-1H-indazole-3-carboxylate
Hazard InformationBack Directory
[Chemical Properties]

Light yellow solid
[Synthesis]

1H-indazole-3-carboxylic acid was dissolved in anhydrous acetic acid in a three-necked flask, heated and stirred. After the substrate was dissolved and clarified, phosphorus oxychloride was dissolved in anhydrous acetic acid and slowly added dropwise. In an oil bath at 90°C, the mixture was condensed back into the chemical book and reacted for 14 hours. After the reaction was complete, a white precipitate was produced. It was cooled in an ice bath, vacuum filtered, and the solid was washed with ethyl acetate first and then with ether to obtain 5-Chloro-1H-indazole-3-carboxylic acid.
[References]

[1] Patent: WO2005/14554, 2005, A1. Location in patent: Page/Page column 60-61
[2] Patent: EP2565192, 2013, A1. Location in patent: Paragraph 0356
[3] Journal of Medicinal Chemistry, 2013, vol. 56, # 15, p. 6259 - 6272
[4] Patent: WO2015/103317, 2015, A1. Location in patent: Page/Page column 97
Questions And AnswerBack Directory
[Application]

5-Chloro-1H-indazole-3-carboxylic acid is an important pharmaceutical intermediate used to construct the core of active drug molecules.
Spectrum DetailBack Directory
[Spectrum Detail]

5-Chloro-1H-indazole-3-carboxylic acid(1077-95-8)1HNMR
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