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Iodine → 2-Amino-2-isopropylpropane-1,3-diol

HRID 1624002
Notes
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Reaction equation

HRID 1624002 reaction equation
[NH2:1][C:2]([CH2:9][OH:10])([CH:6]([CH3:8])[CH3:7])[C:3](O)=[O:4].[BH4-].[Na+].II.CO>C1COCC1.[Cl-].[Na+].O>[NH2:1][C:2]([CH:6]([CH3:8])[CH3:7])([CH2:9][OH:10])[CH2:3][OH:4]
ParticipantsConditionsProcedureWorkupSources & evidenceReaction notes

Participants

7

Reactant 4

HCID 807IodineHCID 887MethanolHCID 27338982-Amino-2-(hydroxymethyl)-3-methylbutanoic acidHCID 4311764Sodium borohydride

Product 1

HCID 123392712-Amino-2-isopropylpropane-1,3-diolYield 11.3%

Reagents, catalysts & solvents 2

HCID 8028
Tetrahydrofuran
Solvent
2×
HCID 57417360Sodium chloride; waterSolvent

Conditions

Temperature
66 °C

Procedure

To a solution of 2-amino-2-(hydroxymethyl)-3-methylbutanoic acid (2943 mg, 20 mmol) in THF (60 mL) was added sodium borohydride (2270 mg, 60.0 mmol). The reaction was cooled in an ice bath, and a THF (10 mL) solution of iodine (7614 mg, 30.0 mmol) was added dropwise. The mixture was refluxed (66° C.) for 16 h. The reaction was cooled in an ice bath, and methanol (10 mL) was added (dropwise at first) followed by brine (75 mL). The mixture was extracted with ethyl acetate (2×50 mL). The combined organic extracts were washed with brine, dried (MgSO4), then filtered. 4 M HCl in dioxane (6 mL) was added. The mixture was then concentrated. Ether was added, and the precipitate was collected to give the title compound (300 mg) as a white solid.

Workup

  1. temperatureThe reaction was cooled in an ice bath
  2. temperatureThe reaction was cooled in an ice bath
  3. extractionThe mixture was extracted with ethyl acetate (2×50 mL)
  4. washThe combined organic extracts were washed with brine
  5. dry with materialdried (MgSO4)
  6. filtrationfiltered
  7. addition4 M HCl in dioxane (6 mL) was added
  8. concentrationThe mixture was then concentrated
  9. additionEther was added
  10. customthe precipitate was collected

Sources & evidence

ORD record
ord-609317fef5d84d8db8dd71447c018295
Source dataset
uspto-grants-2014_07
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US08778950B2

Reaction notes

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On this pageParticipantsConditionsProcedureWorkupSources & evidenceReaction notes