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Iodine → 5-iodo-3-[(R) 1-(2.6-dichloro-3-fluoro-phenyl)-ethoxy]-pyridin-2-ylamine

HRID 2266658
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HRID 2266658 반응식
I(O)(=O)(=O)=O.[I:6]I.S(=O)(=O)(O)O.[Cl:13][C:14]1[C:19]([F:20])=[CH:18][CH:17]=[C:16]([Cl:21])[C:15]=1[C@H:22]([O:24][C:25]1[C:26]([NH2:31])=[N:27][CH:28]=[CH:29][CH:30]=1)[CH3:23]>C(O)(=O)C.O>[I:6][C:29]1[CH:30]=[C:25]([O:24][C@@H:22]([C:15]2[C:16]([Cl:21])=[CH:17][CH:18]=[C:19]([F:20])[C:14]=2[Cl:13])[CH3:23])[C:26]([NH2:31])=[N:27][CH:28]=1
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7

반응물 4

HCID 807IodineHCID 1118Sulfuric AcidHCID 65185Metaperiodic acidHCID 49765905(R)-3-(1-(2,6-Dichloro-3-fluorophenyl)ethoxy)pyridin-2-amine

생성물 1

HCID 115028055-iodo-3-[(R) 1-(2.6-dichloro-3-fluoro-phenyl)-ethoxy]-pyridin-2-ylamine수율 120%

시약·촉매·용매 2

HCID 176
Acetic Acid
용매
HCID 962Water용매

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온도
80 °C

실험 절차

Periodic acid (60 mg, 0.24 mmol), iodine (130 mg, 0.5 mmol), and sulfuric acid (0.03 mL) were added sequentially to a stirred solution of 3-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]pyridin-2-amine (0.97 mmol) in a mixture of acetic acid (3 mL) and H2O (0.5 mL). The resulting solution was heated to 80° C. for 5 h. The cooled reaction mixture was quenched with Na2SO3 (80 mg) and basicified with saturated Na2CO3 (2×100 mL) to pH 7. CH2Cl2 (2×50 mL) was added to extract the aqueous solution. The combined organic layers were dried over Na2SO4 then filtered and concentrated under vacuum. The residue was purified by flash chromatography (eluting with 35→40% EtOAc in hexanes) to give the title compound as a yellow oil (254 mg; 0.6 mmol; 61.6% yield); MS (APCI) (M+H)+ 426. 1H NMR (400 MHz, chloroform-D) δ ppm 1.81 (d, J=6.8 Hz, 3H) 4.86 (s, 2H) 5.98 (q, J=6.57 Hz, 1H) 6.96 (d, J=1.5 Hz, 1H) 7.08 (dd, J=9.0, 8.0 Hz, 1H) 7.31 (dd, J=8.8, 4.8 Hz, 1H) 7.78 (d, J=1.8 Hz, 1H).

후처리

  1. customThe cooled reaction mixture
  2. customwas quenched with Na2SO3 (80 mg)
  3. additionCH2Cl2 (2×50 mL) was added
  4. extractionto extract the aqueous solution
  5. dry with materialThe combined organic layers were dried over Na2SO4
  6. filtrationthen filtered
  7. concentrationconcentrated under vacuum
  8. customThe residue was purified by flash chromatography (eluting with 35→40% EtOAc in hexanes)

출처 및 근거

ORD 기록
ord-516aad3759a3466a9a866461b07e93ce
출처 데이터셋
uspto-grants-2010_12
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US07858643B2

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