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Lithium Hydroxide → 3-cyano-1H-indazole-6-carboxylic acid

HRID 880935
Notes
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Reaction equation

HRID 880935 reaction equation
[C:1]([C:3]1[C:11]2[C:6](=[CH:7][C:8]([C:12]([O:14]C)=[O:13])=[CH:9][CH:10]=2)[NH:5][N:4]=1)#[N:2].[OH-].[Li+]>CO.O1CCCC1>[C:1]([C:3]1[C:11]2[C:6](=[CH:7][C:8]([C:12]([OH:14])=[O:13])=[CH:9][CH:10]=2)[NH:5][N:4]=1)#[N:2]
ParticipantsConditionsProcedureWorkupSources & evidenceReaction notes

Participants

5

Reactant 2

HCID 3939Lithium HydroxideHCID 67491426methyl 3-cyano-1H-indazole-6-carboxylate

Product 1

HCID 674913803-cyano-1H-indazole-6-carboxylic acidYield 37%

Reagents, catalysts & solvents 2

HCID 887MethanolSolventHCID 8028TetrahydrofuranSolvent

Conditions

Temperature
50 °C

Procedure

To a solution of methyl 3-cyano-1H-indazole-6-carboxylate (1.47 g, 7.31 mmol) in methanol (36 mL) and tetrahydrofuran (20 mL) was added 2 N aqueous lithium hydroxide (16 mL, 32 mmol). The reaction was heated to 50° C. for 72 hours. The reaction was cooled to room temperature and concentrated. The residue was diluted with water and the pH was adjusted to 4 with 1 N aqueous hydrochloric acid. The resulting precipitate was filtered off, rinsed with water, and dried under vacuum to provide the title compound (500 mg, 37%) as a tan solid. +ESI (M+H) 188.2.

Workup

  1. temperatureThe reaction was cooled to room temperature
  2. concentrationconcentrated
  3. additionThe residue was diluted with water
  4. filtrationThe resulting precipitate was filtered off
  5. washrinsed with water
  6. customdried under vacuum

Sources & evidence

ORD record
ord-770e34e431f14d28a4ed335de4fe923c
Source dataset
uspto-grants-2015_03
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US08993586B2

Reaction notes

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On this pageParticipantsConditionsProcedureWorkupSources & evidenceReaction notes