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Potassium Cation → Ethyl 3-(5-chloropent-1-enyl)-5-fluoro-1-(3-naphthalen-1-yloxypropyl)indole-2-carboxylate

HRID 2134601
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HRID 2134601 반응식
[Br:1][c:2]1[c:3]([C:26](=[O:27])[O:28][CH2:29][CH3:30])[n:4]([CH2:12][CH2:13][CH2:14][O:15][c:16]2[cH:17][cH:18][cH:19][c:20]3[cH:21][cH:22][cH:23][cH:24][c:25]23)[c:5]2[cH:6][cH:7][c:8]([F:11])[cH:9][c:10]12.[C:83]([O:84][Pd:85][O:86][C:87](=[O:88])[CH3:89])(=[O:90])[CH3:91].[CH:46]1([P:47]([CH:48]2[CH2:49][CH2:50][CH2:51][CH2:52][CH2:53]2)[c:54]2[cH:55][cH:56][cH:57][cH:58][c:59]2-[c:60]2[c:61]([O:62][CH3:63])[cH:64][cH:65][cH:66][c:67]2[O:68][CH3:69])[CH2:70][CH2:71][CH2:72][CH2:73][CH2:74]1.[Cl:31][CH2:32][CH2:33][CH2:34][CH:35]=[CH:36][B:37]1[O:38][C:39]([CH3:40])([CH3:41])[C:42]([CH3:43])([CH3:44])[O:45]1.[K+:80].[K+:81].[K+:82].[P:75]([O-:76])([O-:77])([O-:78])=[O:79]>>[c:2]1([CH:36]=[CH:35][CH2:34][CH2:33][CH2:32][Cl:31])[c:3]([C:26](=[O:27])[O:28][CH2:29][CH3:30])[n:4]([CH2:12][CH2:13][CH2:14][O:15][c:16]2[cH:17][cH:18][cH:19][c:20]3[cH:21][cH:22][cH:23][cH:24][c:25]23)[c:5]2[cH:6][cH:7][c:8]([F:11])[cH:9][c:10]12
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 813Potassium Cation3회HCID 1061PhosphateHCID 167845palladium(II) acetateHCID 112698722-Dicyclohexylphosphino-2',6'-dimethoxybiphenylHCID 53399116trans-5-Chloro-1-penten-1-ylboronic acid pinacol esterHCID 67316184ethyl 3-bromo-5-fluoro-1-(3-(naphthalen-1-yloxy)propyl)-1H-indole-2-carboxylate

생성물 1

HCID 91300929Ethyl 3-(5-chloropent-1-enyl)-5-fluoro-1-(3-naphthalen-1-yloxypropyl)indole-2-carboxylate

출처 및 근거

ORD 기록
ord-67d22ee4df10497f8d89cc0d81e00040
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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