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Triphenylphosphine → Methyl 3-{[(2,6-dichlorophenyl)thio]methyl}-5-(1-methylethyl)-4-isoxazolecarboxylate

HRID 2423466
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HRID 2423466 반응식
[Cl:1][C:2]1[CH:7]=[CH:6][CH:5]=[C:4]([Cl:8])[C:3]=1[SH:9].O[CH2:11][C:12]1[C:16]([C:17]([O:19][CH3:20])=[O:18])=[C:15]([CH:21]([CH3:23])[CH3:22])[O:14][N:13]=1.C1(P(C2C=CC=CC=2)C2C=CC=CC=2)C=CC=CC=1.N(C(OC(C)(C)C)=O)=NC(OC(C)(C)C)=O>ClCCl>[Cl:1][C:2]1[CH:7]=[CH:6][CH:5]=[C:4]([Cl:8])[C:3]=1[S:9][CH2:11][C:12]1[C:16]([C:17]([O:19][CH3:20])=[O:18])=[C:15]([CH:21]([CH3:23])[CH3:22])[O:14][N:13]=1
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참가 물질

6

반응물 4

HCID 11776TriphenylphosphineHCID 90671Benzenethiol, 2,6-dichloro-HCID 97268Di-tert-butyl azodicarboxylateHCID 59321585HCID 59321585, 화합물

생성물 1

HCID 59321546Methyl 3-{[(2,6-dichlorophenyl)thio]methyl}-5-(1-methylethyl)-4-isoxazolecarboxylate수율 100%

시약·촉매·용매 1

HCID 6344
Dichloromethane
용매

실험 절차

To a solution of 2,6-dichlorobenzenethiol (530 mg, 2.96 mmol), methyl 3-(hydroxymethyl)-5-(1-methylethyl)-4-isoxazolecarboxylate (629 mg, 2.46 mmol) and triphenylphosphine (1.29 g, 4.93 mmol) in dichloromethane (20 mL) was added di-tert-butyl azodicarboxylate (1.14 g, 4.93 mmol). The solution was stirred at ambient temperature overnight. The solution was then adsorbed onto silica gel and purified by chromatography (silica gel, 0-100% ethyl acetate in hexanes gradient elution) to afford methyl 3-{[(2,6-dichlorophenyl)thio]methyl}-5-(1-methylethyl) -4-isoxazolecarboxylate (886 mg, 100%). 1H-NMR (400 MHz, CDCl3) δ 7.52-7.35 (m, 3H), 4.18 (s, 3H), 3.72 (s, 2H), 3.64 (septet, J=7 Hz, 1H), 1.20 (d, J=7 Hz, 6H). LRMS (APCI) m/z 360 (M+H)+.

후처리

  1. custompurified by chromatography (silica gel, 0-100% ethyl acetate in hexanes gradient elution)

출처 및 근거

ORD 기록
ord-c7ddf24e99e94215849b6c1ff3b902ff
출처 데이터셋
uspto-grants-2011_06
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US07960552B2

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