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Water → 2,6'-Bis(hydroxymethyl)-4,2',3',4'-tetramethoxybiphenyl-3-yl methanesulfonate

HRID 1925092
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HRID 1925092 반응식
[CH3:1][S:2]([O:5][C:6]1[C:7]([CH:28]=[O:29])=[C:8]([C:14]2[C:19]([CH:20]=[O:21])=[CH:18][C:17]([O:22][CH3:23])=[C:16]([O:24][CH3:25])[C:15]=2[O:26][CH3:27])[CH:9]=[CH:10][C:11]=1[O:12][CH3:13])(=[O:4])=[O:3].[BH4-].[Na+].O.C(OCC)(=O)C>CO>[CH3:1][S:2]([O:5][C:6]1[C:7]([CH2:28][OH:29])=[C:8]([C:14]2[C:19]([CH2:20][OH:21])=[CH:18][C:17]([O:22][CH3:23])=[C:16]([O:24][CH3:25])[C:15]=2[O:26][CH3:27])[CH:9]=[CH:10][C:11]=1[O:12][CH3:13])(=[O:4])=[O:3]
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

6

반응물 4

HCID 962WaterHCID 8857Ethyl AcetateHCID 4311764Sodium borohydrideHCID 866380392,6'-Diformyl-4,2',3',4'-tetramethoxybiphenyl-3-yl methanesulfonate

생성물 1

HCID 866380412,6'-Bis(hydroxymethyl)-4,2',3',4'-tetramethoxybiphenyl-3-yl methanesulfonate수율 96%

시약·촉매·용매 1

HCID 887
Methanol
용매

실험 절차

To a solution of 2,6′-diformyl-4,2′,3′,4′-tetramethoxybiphenyl-3-yl methanesulfonate (170 mg, 0.40 mmol) in methanol (4 mL) was added sodium borohydride (45 mg, 1.20 mmol) and the solution was stirred at room temperature for 1 hour. Water (20 mL) and ethyl acetate (20 mL) were added to the reaction, the layers were separated and the aqueous layer was extracted with ethyl acetate (2×20 mL). The combined extracts were dried over Na2SO4 and filtered. The solvent was removed in vacuo and the residue was purified by flash chromatography over silica gel (25 g), eluting with hexane-ethyl acetate (1:2), followed by crystallisation (ethyl acetate), which yielded 2,6′-bis(hydroxymethyl)-4,2′,3′,4′-tetramethoxybiphenyl-3-yl methanesulfonate as a white solid (164 mg, 96%); m.p. 124-126° C.; High Resolution Mass Spectrometry Found: M+Na+ 451.1041 (C18H20O7Na requires 451.1039); NMR Spectrum δH (300 MHz, CDCl3) 7.08 (1H, d, J 8.4 Hz, 6-H), 7.01 (1H, d, J 8.4 Hz, 5-H), 4.64 (1H, d, J 12.0 Hz, 2-CHAOH), 4.26 (1H, d, J 12.0 Hz, 2-CHBOH), 4.18 (2H, dd, J 2.9, 11.8 Hz, 6′-CH2OH), 3.94 (3H, s, OCH3), 3.92 (3H, s, OCH3), 3.88 (3H, s, OCH3), 3.56 (3H, s, OCH3), 3.40 (3H, s, SCH3); NMR Spectrum δC (75 MHz, CDCl3) 50.2, 56.5, 56.9, 61.2, 61.5, 106.2, 116.8, 127.5, 130.0, 130.7, 131.0, 132.1, 139.8, 147.6, 151.1, 152.6, 154.0, 189.3, 190.5; νmax/cm−1 (thin film) 3219, 2947, 1607, 1484, 1410, 1363, 1328, 1278, 1161, 1111, 1006, 889; m/z (ES) 447 (MNa2H2O+, 100%); Rf (hexane-ethyl acetate 1:2) 0.18.

후처리

  1. customthe layers were separated
  2. extractionthe aqueous layer was extracted with ethyl acetate (2×20 mL)
  3. dry with materialThe combined extracts were dried over Na2SO4
  4. filtrationfiltered
  5. customThe solvent was removed in vacuo
  6. customthe residue was purified by flash chromatography over silica gel (25 g)
  7. washeluting with hexane-ethyl acetate (1:2)
  8. customfollowed by crystallisation (ethyl acetate), which

출처 및 근거

ORD 기록
ord-f597316480d84cf1b3be53d13e3e04e1
출처 데이터셋
uspto-grants-2012_05
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08178578B2

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