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6-Aminohexanoic Acid → 6-Benzamidohexanoic acid

HRID 2100011
Notes
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Reaction equation

HRID 2100011 reaction equation
[NH2:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][C:7]([OH:9])=[O:8].[OH-].[Na+].[C:12](Cl)(=[O:19])[C:13]1[CH:18]=[CH:17][CH:16]=[CH:15][CH:14]=1>O.O1CCOCC1.O.[Cl-].[Na+].O>[C:12]([NH:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][C:7]([OH:9])=[O:8])(=[O:19])[C:13]1[CH:18]=[CH:17][CH:16]=[CH:15][CH:14]=1
ParticipantsProcedureWorkupSources & evidenceReaction notes

Participants

7

Reactant 3

HCID 5646-Aminohexanoic AcidHCID 7412Benzoyl chlorideHCID 14798Sodium Hydroxide

Product 1

HCID 703886-Benzamidohexanoic acid

Reagents, catalysts & solvents 3

HCID 962WaterSolventHCID 218864351,4-Dioxane--water (1/1)Solvent
HCID 57417360
Sodium chloride; water
Solvent

Procedure

(Method J10) To the solution of 6-aminocaproic acid (2h) (0.982 g, 7.5 mmol) in water/dioxane (1:1) mixture (30 ml) NaOH (0.8 g, 20 mmol) in H2O (2 ml) and benzoyl chloride (1/67) (1.16 ml, 10 mmol) were added. The mixture was stirred for 6 h at room temperature and diluted with brine (150 ml). The mixture was washed with diethyl ether (2×25 ml), acidified with conc. HCl to pH 4, and extracted with ethyl acetate (4×25 ml). The organic solution was washed with brine (3×25 ml), dried (Na2SO4) and evaporated. The crude title compound (1.589 g, 90%) was purified by column chromatography on silica gel with chloroform -ethyl acetate (1:2) as eluent. 1H NMR (CDCl3, HMDS) δ: 1.18-1.85(m, 6H); 2.34(t, J=7.0 Hz, 2H); 3.45(q, J=6.0 Hz, 2H); 6.27(bs, 1H); 7.29-7.52(m, 3H); 7.61-7.85(m, 2H); 10.41(bs, 1H).

Workup

  1. washThe mixture was washed with diethyl ether (2×25 ml)
  2. extractionextracted with ethyl acetate (4×25 ml)
  3. washThe organic solution was washed with brine (3×25 ml)
  4. dry with materialdried (Na2SO4)
  5. customevaporated
  6. customThe crude title compound (1.589 g, 90%) was purified by column chromatography on silica gel with chloroform -ethyl acetate (1:2) as eluent

Sources & evidence

ORD record
ord-76c9995a346944af8abe5362acc835b6
Source dataset
uspto-grants-2009_08
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US07569724B2

Reaction notes

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On this pageParticipantsProcedureWorkupSources & evidenceReaction notes