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

Water → 1-((Difluoromethoxy)methyl)cyclobutanecarboxylic acid

HRID 920738
Notes
Print preview

Reaction equation

HRID 920738 reaction equation
[F:1][CH:2]([F:14])[O:3][CH2:4][C:5]1([C:9]([O:11]CC)=[O:10])[CH2:8][CH2:7][CH2:6]1.O.[OH-].[Na+]>C(O)C.C1COCC1>[F:1][CH:2]([F:14])[O:3][CH2:4][C:5]1([C:9]([OH:11])=[O:10])[CH2:8][CH2:7][CH2:6]1
ParticipantsProcedureWorkupSources & evidenceReaction notes

Participants

6

Reactant 3

HCID 962WaterHCID 14798Sodium HydroxideHCID 118062437Ethyl 1-((difluoromethoxy)methyl)cyclobutanecarboxylate

Product 1

HCID 1180628681-((Difluoromethoxy)methyl)cyclobutanecarboxylic acidYield 35.2%

Reagents, catalysts & solvents 2

HCID 702EthanolSolvent
HCID 8028
Tetrahydrofuran
Solvent

Procedure

To a stirred solution of Intermediate 223A (0.263 g, 1.263 mmol) in ethanol (3.5 mL), THF (3.5 mL), and water (3 mL) was added NaOH (0.152 g, 3.79 mmol) and the reaction mixture was stirred at RT for 16 h. The reaction mixture was concentrated and the residue dissolved in water and extracted with ethyl acetate (3×15 mL) The aqueous layer was then acidified to pH 2-3 using a 1.5 N aqueous solution of HCl and extracted with EtOAc (3×15 mL). The combined organic layer was washed with water, dried over Na2SO4 and concentrated to afford Intermediate 223B as a brown oil (0.08 g, 35% yield). 1H NMR (400 MHz, DMSO-d6) δ ppm 12.41 (s, 1H), 6.97-6.40 (m, 1H), 4.15-3.90 (m, 2H), 2.38-2.09 (m, 2H), 2.01-1.51 (m, 4H).

Workup

  1. concentrationThe reaction mixture was concentrated
  2. dissolutionthe residue dissolved in water
  3. extractionextracted with ethyl acetate (3×15 mL) The aqueous layer
  4. extractionextracted with EtOAc (3×15 mL)
  5. washThe combined organic layer was washed with water
  6. dry with materialdried over Na2SO4
  7. concentrationconcentrated

Sources & evidence

ORD record
ord-a2ae08625a4948018e24eb7b47615d95
Source dataset
uspto-grants-2016_03
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US09273058B2

Reaction notes

Loading…

On this pageParticipantsProcedureWorkupSources & evidenceReaction notes