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Acetate → 5-Bromo-1-{3-fluoro-4-[(phenylmethyl)oxy]phenyl}-4-(methyloxy)-1H-indazole

HRID 176283
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인쇄 미리보기

반응식

HRID 176283 반응식
[Br:1][c:2]1[c:3]([O:11][CH3:12])[c:4]2[cH:5][n:6][nH:7][c:8]2[cH:9][cH:10]1.[C:46]([O-:47])(=[O:48])[CH3:49].[C:51]([O-:52])(=[O:53])[CH3:54].[CH2:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[O:20][c:21]1[c:22]([F:30])[cH:23][c:24]([B:27]([OH:28])[OH:29])[cH:25][cH:26]1.[CH3:40][CH2:41][O:42][C:43](=[O:44])[CH3:45].[Cl:37][CH2:38][Cl:39].[Cu+2:50].[cH:31]1[cH:32][cH:33][n:34][cH:35][cH:36]1>>[Br:1][c:2]1[c:3]([O:11][CH3:12])[c:4]2[cH:5][n:6][n:7](-[c:24]3[cH:23][c:22]([F:30])[c:21]([O:20][CH2:13][c:14]4[cH:15][cH:16][cH:17][cH:18][cH:19]4)[cH:26][cH:25]3)[c:8]2[cH:9][cH:10]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 175Acetate2회HCID 1049PyridineHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 27099Cupric cationHCID 27377884-Benzyloxy-3-fluorophenylboronic AcidHCID 231345645-bromo-4-methoxy-1H-indazole

생성물 1

HCID 592729765-Bromo-1-{3-fluoro-4-[(phenylmethyl)oxy]phenyl}-4-(methyloxy)-1H-indazole

출처 및 근거

ORD 기록
ord-582cf6fe9bea4ff1bea93da73f8ca030
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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