HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Reaction

Water → 8-Chloro-1H-pyrido[2,3-B][1,4]oxazin-2(3H)-one

HRID 1943759
Notes
Print preview

Reaction equation

HRID 1943759 reaction equation
[NH2:1][C:2]1[C:3]([OH:9])=[N:4][CH:5]=[CH:6][C:7]=1[Cl:8].Cl[CH2:11][C:12](Cl)=[O:13].C(=O)([O-])[O-].[K+].[K+].O>CN(C)C=O>[Cl:8][C:7]1[C:2]2[NH:1][C:12](=[O:13])[CH2:11][O:9][C:3]=2[N:4]=[CH:5][CH:6]=1
ParticipantsProcedureWorkupSources & evidenceReaction notes

Participants

6

Reactant 4

HCID 962WaterHCID 6577Chloroacetyl chlorideHCID 11430Potassium CarbonateHCID 178507836HCID 178507836, compound

Product 1

HCID 669363978-Chloro-1H-pyrido[2,3-B][1,4]oxazin-2(3H)-oneYield 73.4%

Reagents, catalysts & solvents 1

HCID 6228
Dimethylformamide
Solvent

Procedure

3-amino-4-chloro-pyridin-2-ol (650 mg, 4.49 mmol) was dissolved in anhydrous N,N-dimethyl formamide (22 ml) under nitrogen atmosphere, and chloroacetyl chloride solution (0.394 ml, 4.94 mmol) was added thereto dropwise at room temperature and stirred for 30 minutes. Potassium carbonate (1.55 g, 11.24 mmol) was added thereto dropwise at room temperature, and the reaction mixture was heated to 1000 and stirred for 18 hours. The reaction mixture was cooled to room temperature and water was added to quench the reaction, and the organic layer was extracted with ethyl acetate. The combined organic layer was washed with water and saturated saline solution, dried over anhydrous sodium sulfate (Na2SO4), filtered and evaporated under reduced pressure. The residue was recrystallized from dichloromethane and diisopropyl ether to obtain white solid (608 mg, 73%).

Workup

  1. temperaturedropwise at room temperature, and the reaction mixture was heated to 1000
  2. stirringstirred for 18 hours
  3. temperatureThe reaction mixture was cooled to room temperature
  4. customto quench
  5. customthe reaction
  6. extractionthe organic layer was extracted with ethyl acetate
  7. washThe combined organic layer was washed with water and saturated saline solution
  8. dry with materialdried over anhydrous sodium sulfate (Na2SO4)
  9. filtrationfiltered
  10. customevaporated under reduced pressure
  11. customThe residue was recrystallized from dichloromethane and diisopropyl ether

Sources & evidence

ORD record
ord-5785950ace3e4049a91d0294388df867
Source dataset
uspto-grants-2013_03
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US08394792B2

Reaction notes

Loading…

On this pageParticipantsProcedureWorkupSources & evidenceReaction notes