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Methyl chloroformate → (3-Chloropyrazin-2-yl)methanol

HRID 1471718
Notes
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Reaction equation

HRID 1471718 reaction equation
[Cl:1][C:2]1[C:3]([C:8](O)=[O:9])=[N:4][CH:5]=[CH:6][N:7]=1.ClC(OC)=O.[BH4-].[Na+]>C1COCC1.O>[Cl:1][C:2]1[C:3]([CH2:8][OH:9])=[N:4][CH:5]=[CH:6][N:7]=1
ParticipantsConditionsProcedureWorkupSources & evidenceReaction notes

Participants

6

Reactant 3

HCID 6586Methyl chloroformateHCID 15019003-Chloro-2-pyrazine-carboxylic acidHCID 4311764Sodium borohydride

Product 1

HCID 40152213(3-Chloropyrazin-2-yl)methanolYield 22%

Reagents, catalysts & solvents 2

HCID 962WaterSolventHCID 8028
Tetrahydrofuran
Solvent

Conditions

Temperature
0 °C

Procedure

To a solution of 3-chloropyrazine-2-carboxylic acid (2.0 g, 12.70 mmol, 1.0 eq.) and TEA (3.50 mL, 25.40 mmol, 2.0 eq.) in THF (50 mL) was added methyl chloroformate (1.2 mL, 15.20 mmol, 1.2 eq.) at 0° C. The mixture was stirred at 0° C. for 10 min and filtered. To this filtrate was added a suspension of NaBH4 (0.97 g, 25.40 mmol, 2 eq.) in water (1.0 mL) at 0° C. The mixture was stirred at 0° C. for 1 h, quenched with NH4Cl(aq) solution, and extracted with EtOAc twice. The combined organic layers were dried over Na2SO4, concentrated, and purified on silica gel using a mixture of EtOAc and hexanes as eluent to give (3-chloropyrazin-2-yl)methanol (400 mg, 22%) as a white solid. 1H NMR (400 MHz, MeOD) δ 8.58 (d, J=2.5 Hz, 1H), 8.38 (d, J=2.5 Hz, 1H), 4.84 (s, 2H). LRMS (M+H+) m/z 145.1.

Workup

  1. filtrationfiltered
  2. additionTo this filtrate was added
  3. stirringThe mixture was stirred at 0° C. for 1 h
  4. customquenched with NH4Cl(aq) solution
  5. extractionextracted with EtOAc twice
  6. dry with materialThe combined organic layers were dried over Na2SO4
  7. concentrationconcentrated
  8. custompurified on silica gel using
  9. additiona mixture of EtOAc and hexanes as eluent

Sources & evidence

ORD record
ord-2b11664989d24ded85fd1d515b5d0831
Source dataset
uspto-grants-2015_04
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US09012450B2

Reaction notes

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