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Hydrochloric Acid → 697305-72-9

HRID 1750880
Notes
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Reaction equation

HRID 1750880 reaction equation
Cl.[Cl:2][C:3]1[CH:8]=[CH:7][C:6]([N+:9]([O-])=O)=[CH:5][C:4]=1[CH2:12][N:13]([CH3:15])[CH3:14]>[Fe].C(O)C.O>[Cl:2][C:3]1[CH:8]=[CH:7][C:6]([NH2:9])=[CH:5][C:4]=1[CH2:12][N:13]([CH3:15])[CH3:14]
ParticipantsProcedureWorkupSources & evidenceReaction notes

Participants

5

Reactant 2

HCID 313Hydrochloric AcidHCID 43091262HCID 43091262, compound

Product 1

HCID 28721435697305-72-9Yield 55%

Reagents, catalysts & solvents 2

HCID 23925IronCatalystHCID 19096565Water ethanolSolvent

Procedure

Iron (1.36 g, 21.9 mmol) and concentrated hydrochloric acid (0.15 mL) was added to ethanol/water (20 mL/20 mL), followed by refluxing for 1 hour. The mixed reaction solution was added with 1-(2-chloro-5-nitrophenyl)-N,N-dimethylmethanamine (940 mg, 4.38 mmol) obtained in <Step 1> above, and refluxed for 1 hour. The reaction mixture was filtered through a Celite pad under reduced pressure, and washed with ethanol and chloroform/2-propanol=3/1 (v/v). The resulting filtrate was distilled under reduced pressure, and dissolved in ethyl acetate. The organic layer formed was washed with an aqueous solution of sodium bicarbonate and brine. The obtained organic layer was dried over anhydrous sodium sulfate, filtered and concentrated under reduced pressure. The concentrated compound was purified using silica gel chromatography (chloroform:methanol=30:1→15:1 (v/v)) to obtain the title compound (442 mg, 55%).

Workup

  1. temperatureby refluxing for 1 hour
  2. customThe mixed reaction solution
  3. customobtained in <Step 1> above, and
  4. temperaturerefluxed for 1 hour
  5. filtrationThe reaction mixture was filtered through a Celite pad under reduced pressure
  6. washwashed with ethanol and chloroform/2-propanol=3/1 (v/v)
  7. distillationThe resulting filtrate was distilled under reduced pressure
  8. dissolutiondissolved in ethyl acetate
  9. customThe organic layer formed
  10. washwas washed with an aqueous solution of sodium bicarbonate and brine
  11. dry with materialThe obtained organic layer was dried over anhydrous sodium sulfate
  12. filtrationfiltered
  13. concentrationconcentrated under reduced pressure
  14. customThe concentrated compound was purified

Sources & evidence

ORD record
ord-eeb5f0572dbd4ecdad130f6af017356d
Source dataset
uspto-grants-2015_10
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US09156852B2

Reaction notes

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On this pageParticipantsProcedureWorkupSources & evidenceReaction notes