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

Hydrochloric Acid → (E)-3-[5-(4-tert-butylphenyl)thiophen-2-yl]acrylic acid

HRID 1277243
Notes
Print preview

Reaction equation

HRID 1277243 reaction equation
[C:1]([C:5]1[CH:10]=[CH:9][C:8]([C:11]2[S:15][C:14](/[CH:16]=[CH:17]/[C:18]([O:20]C)=[O:19])=[CH:13][CH:12]=2)=[CH:7][CH:6]=1)([CH3:4])([CH3:3])[CH3:2].[OH-].[Na+].Cl>C1COCC1.C(O)C>[C:1]([C:5]1[CH:6]=[CH:7][C:8]([C:11]2[S:15][C:14](/[CH:16]=[CH:17]/[C:18]([OH:20])=[O:19])=[CH:13][CH:12]=2)=[CH:9][CH:10]=1)([CH3:4])([CH3:2])[CH3:3]
ParticipantsProcedureWorkupSources & evidenceReaction notes

Participants

5

Reactant 3

HCID 313Hydrochloric AcidHCID 14798Sodium HydroxideHCID 86756177methyl (E)-3-[5-(4-tert-butylphenyl)thiophen-2-yl]acrylate

Product 1

HCID 18472379(E)-3-[5-(4-tert-butylphenyl)thiophen-2-yl]acrylic acidYield 82.6%

Reagents, catalysts & solvents 1

HCID 21873804Tetrahydrofuran ethanolSolvent

Procedure

To a solution of methyl (E)-3-[5-(4-tert-butylphenyl)-thiophen-2-yl]acrylate (190 mg) of THF/ethanol (15/15 ml) was added at room temperature 2N sodium hydroxide solution (2.0 ml), and the mixture was stirred 18 hours. To the mixture was added 1N hydrochloric acid (5 ml), and the mixture was extracted with ethyl acetate. The organic layer was washed with saturated brine and dried with magnesium sulfate. Under reduced pressure, the mixture was concentrated, and the precipitated crystals were collected by filtration, which were washed with hexane to give yellow crystals of (E)-3-[5-(4-tert-butylphenyl)thiophen-2-yl]acrylic acid (149.7 mg). This compound was used for the following reaction, without subjecting further purification.

Workup

  1. extractionthe mixture was extracted with ethyl acetate
  2. washThe organic layer was washed with saturated brine
  3. dry with materialdried with magnesium sulfate
  4. concentrationUnder reduced pressure, the mixture was concentrated
  5. filtrationthe precipitated crystals were collected by filtration, which
  6. washwere washed with hexane

Sources & evidence

ORD record
ord-23f385ad657d4120ad742ad730c8fad6
Source dataset
uspto-grants-2000_12
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US06166006

Reaction notes

Loading…

On this pageParticipantsProcedureWorkupSources & evidenceReaction notes