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tert-Butyl (triphenylphosphoranylidene) acetate → HCID 44139028, compound

HRID 883808
Notes
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Reaction equation

HRID 883808 reaction equation
[CH3:1]/[C:2](=[CH:5]\[C:6]1[CH:11]=[CH:10][C:9]([N+:12]([O-:14])=[O:13])=[CH:8][CH:7]=1)/[CH:3]=O.[C:15]([O:19][C:20]([CH:22]=P(C1C=CC=CC=1)(C1C=CC=CC=1)C1C=CC=CC=1)=[O:21])([CH3:18])([CH3:17])[CH3:16]>C(#N)C>[CH3:1]/[C:2](=[CH:5]\[C:6]1[CH:11]=[CH:10][C:9]([N+:12]([O-:14])=[O:13])=[CH:8][CH:7]=1)/[CH:3]=[CH:22]/[C:20]([O:19][C:15]([CH3:18])([CH3:17])[CH3:16])=[O:21]
ParticipantsConditionsProcedureWorkupSources & evidenceReaction notes

Participants

4

Reactant 2

HCID 256127tert-Butyl (triphenylphosphoranylidene) acetateHCID 5370537HCID 5370537, compound

Product 1

HCID 44139028HCID 44139028, compoundYield 53.2%

Reagents, catalysts & solvents 1

HCID 6342AcetonitrileSolvent

Conditions

Temperature
65 °C

Procedure

(E)-2-Methyl-3-(4-nitrophenyl)prop-2-enal (3.0 g, 15.6 mmol), (tert-butoxycarbonyl methylene)triphenylphosphorane (8.85 g, 23.4 mmol) and dry acetonitrile (60 ml) were stirred and heated at 65° C. until reaction was complete (ca. 1 h, HPLC monitoring). The mixture was cooled, filtered to remove some insoluble by-product, and the filtrate concentrated in vacuo to ca. 15 ml volume. On cooling the product deposited, was collected by filtration and washed with cold acetonitrile to give a yellow solid (2.4 g), mp 120-122° C. The mother liquors were evaporated to dryness, the residue stirred in ether (20 ml) and the insoluble material removed by filtration. The filtrate was concentrated in vacuo and the residue crystallised from acetonitrile (5 ml) to give a second crop of product (1.3 g). Total yield=3.7 g (87%)

Workup

  1. custom(ca. 1 h, HPLC monitoring)
  2. temperatureThe mixture was cooled
  3. filtrationfiltered
  4. customto remove some insoluble by-product
  5. concentrationthe filtrate concentrated in vacuo to ca. 15 ml volume
  6. temperatureOn cooling the product
  7. filtrationwas collected by filtration
  8. washwashed with cold acetonitrile

Sources & evidence

ORD record
ord-e28a47ef92f640f5ac1a8eda6025d5d6
Source dataset
uspto-grants-2012_08
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US08236985B2

Reaction notes

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On this pageParticipantsConditionsProcedureWorkupSources & evidenceReaction notes