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Chlorotrimethylsilane → ethyl 3-(N-tert.-butoxycarbonylamino)-2-hydroxy-2-methyl-propyl-(n-butyl)phosphinate

HRID 1612777
Notes
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Reaction equation

HRID 1612777 reaction equation
[CH2:1]([PH:5](=[O:9])[O:6][CH2:7][CH3:8])[CH2:2][CH2:3][CH3:4].C(N(CC)CC)C.C[Si](C)(C)Cl.[C:22]([O:26][C:27]([NH:29][CH:30]1[O:33][C:31]1([CH3:34])[CH3:32])=[O:28])([CH3:25])([CH3:24])[CH3:23]>O1CCCC1.ClCCl.[Cl-].[Zn+2].[Cl-]>[C:22]([O:26][C:27]([NH:29][CH2:30][C:31]([OH:33])([CH3:34])[CH2:32][P:5]([CH2:1][CH2:2][CH2:3][CH3:4])(=[O:9])[O:6][CH2:7][CH3:8])=[O:28])([CH3:25])([CH3:24])[CH3:23]
ParticipantsProcedureWorkupSources & evidenceReaction notes

Participants

8

Reactant 4

HCID 6397ChlorotrimethylsilaneHCID 8471TriethylamineHCID 197764923-(N-tert.-butoxycarbonylamino)-2-methyl-2,3-epoxypropaneHCID 178454912HCID 178454912, compound

Product 1

HCID 10449729ethyl 3-(N-tert.-butoxycarbonylamino)-2-hydroxy-2-methyl-propyl-(n-butyl)phosphinate

Reagents, catalysts & solvents 3

HCID 3007855
Zincchloride
Catalyst
HCID 6344DichloromethaneSolvent
HCID 8028TetrahydrofuranSolvent2×

Procedure

A solution of 15.0 g of ethyl n-butylphosphinate in anhydrous tetrahydrofuran containing 11.11 g of triethylamine is treated under an inert gas with an anhydrous tetrahydrofuran solution of 11.95 g of trimethylchlorosilane. A white precipitate forms immediately and the resulting suspension is stirred for 24 hours at room temperature under an inert gas. The reaction mixture is then filtered under an inert gas and the filtrate concentrated in vacuo to afford a cloudy oil which is then treated with 3.76 g of 3-(N-tert.-butoxycarbonylamino)-2-methyl-2,3-epoxypropane and 1 g of anhydrous zinc chloride. An exothermic reaction results. After the exotherm has subsided the clear solution is heated slowly to 70° and stirred at this temperature for 4 hours, after which time chromatographic analysis indicates the reaction to be complete. The reaction mixture is cooled to room temperature, diluted with dichloromethane and washed with water. Drying of the solvent and removal in vacuo affords an oil. The excess starting material is removed by Kugelrohr-distillation in high vacuum and the pale yellow residue chromatographed on silica-gel to give ethyl 3 -(N-tert.-butoxycarbonylamino)-2-hydroxy-2-methyl-propyl-(n-butyl)phosphinate as a colourless oil; 1H-NMR (CDCl3): δ (ppm)=5.17+4.68 (1H, Exch. D2O, NH), 4.07 (2H, m, CH2OP), 3.18 (2H, m, CH2N), 1.93-1.22 (24H, m, becomes 23H on D2O exchange), 0.92 (3H, t,CH3). 31P-NMR (CDCl3); 59.6, 59.3.

Workup

  1. filtrationThe reaction mixture is then filtered under an inert gas
  2. concentrationthe filtrate concentrated in vacuo
  3. customto afford a cloudy oil which
  4. customAn exothermic reaction
  5. customresults
  6. temperatureis heated slowly to 70°
  7. stirringstirred at this temperature for 4 hours
  8. customthe reaction
  9. temperatureThe reaction mixture is cooled to room temperature
  10. washwashed with water
  11. customDrying of the solvent and removal in vacuo
  12. customaffords an oil
  13. customis removed by Kugelrohr-distillation in high vacuum
  14. customthe pale yellow residue chromatographed on silica-gel

Sources & evidence

ORD record
ord-871376fed4814955bbaaf0aefb146cff
Source dataset
uspto-grants-1993_03
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US05190934

Reaction notes

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On this pageParticipantsProcedureWorkupSources & evidenceReaction notes