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Diethyl (2,3-dibromopropyl)phosphonate → Diethyl 3-bromo-cis-1-propenylphosphonate

HRID 1706175
Notes
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Reaction equation

HRID 1706175 reaction equation
Br[CH:2]([CH2:12][Br:13])[CH2:3][P:4](=[O:11])([O:8][CH2:9][CH3:10])[O:5][CH2:6][CH3:7].CC(C)([O-])C.[K+]>C(O)(C)(C)C>[Br:13][CH2:12]/[CH:2]=[CH:3]\[P:4](=[O:11])([O:5][CH2:6][CH3:7])[O:8][CH2:9][CH3:10]
ParticipantsProcedureWorkupSources & evidenceReaction notes

Participants

4

Reactant 2

HCID 15415235Diethyl (2,3-dibromopropyl)phosphonateHCID 23665647Potassium tert-butoxide

Product 1

HCID 22809706Diethyl 3-bromo-cis-1-propenylphosphonateYield 0.4%

Reagents, catalysts & solvents 1

HCID 6386tert-ButanolSolvent

Procedure

To a solution of diethyl 2,3-dibromopropylphosphonate (3.34 g.) in tert.-butanol (10 ml.) was added dropwise a solution of potassium tert.-butoxide (K: 430 mg., tert.--C4H9OH: 14 ml.) at ambient temperature in the course of 15 minutes. The reaction mixture was stirred at the same temperature for 30 minutes. The resultant mixture was concentrated under reduced pressure and then the residue was shaken with a mixture of ethyl acetate (50 ml.) and water (30 ml.). The ethyl acetate layer was separated, wshed with water (30 ml.), dried over magnesium sulfate and evaporated to dryness under reduced pressure to give an oily mixture of isomeric diethyl 3-bromo-propenylphosphonates (2.13 g.). An aliquot (1.86 g.) of which was fractionated by subjecting to a column chromatography on silica gel (developing solvent: chloroform) into two fractions (i.e. fraction A and fraction B). The fraction A was evaporated to dryness under reduced pressure to give oily diethyl 3-bromo-cis-1-propenylphosphonate (10 mg.). The fraction B was evaporated to dryness under reduced pressure to give oily mixture (1.65 g.) of diethyl 3-bromo-2-propenylphosphonate and diethyl 3-bromo-trans-1-propenylphosphonate (molar ratio: ca 1:1).

Workup

  1. concentrationThe resultant mixture was concentrated under reduced pressure
  2. stirringthe residue was shaken with a mixture of ethyl acetate (50 ml.) and water (30 ml.)
  3. customThe ethyl acetate layer was separated
  4. dry with materialdried over magnesium sulfate
  5. customevaporated to dryness under reduced pressure
  6. customto give
  7. customThe fraction A was evaporated to dryness under reduced pressure

Sources & evidence

ORD record
ord-fdc362d296d244bca50ed37a368ca6c5
Source dataset
uspto-grants-1980_06
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US04206156

Reaction notes

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On this pageParticipantsProcedureWorkupSources & evidenceReaction notes