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Potassium Cation → 2-Amino-3-cyano-4-methyl-5-[3-(4-chlorophenyl)phenyl]pyridine

HRID 1143486
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HRID 1143486 반응식
[C:28](=[O:29])([O-:30])[O-:31].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[Cl:12][c:13]1[cH:14][cH:15][c:16](-[c:19]2[cH:20][c:21]([B:25]([OH:26])[OH:27])[cH:22][cH:23][cH:24]2)[cH:17][cH:18]1.[K+:32].[K+:33].[NH2:1][c:2]1[n:3][cH:4][c:5]([Br:11])[c:6]([CH3:10])[c:7]1[C:8]#[N:9]>>[NH2:1][c:2]1[n:3][cH:4][c:5](-[c:21]2[cH:20][c:19](-[c:16]3[cH:15][cH:14][c:13]([Cl:12])[cH:18][cH:17]3)[cH:24][cH:23][cH:22]2)[c:6]([CH3:10])[c:7]1[C:8]#[N:9]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 813Potassium Cation2회HCID 1140TolueneHCID 19660Carbonate IonHCID 113218062-Amino-5-bromo-4-methylnicotinonitrileHCID 23005392[3-(4-Chlorophenyl)phenyl]boronic acid

생성물 1

HCID 197072002-Amino-3-cyano-4-methyl-5-[3-(4-chlorophenyl)phenyl]pyridine

출처 및 근거

ORD 기록
ord-40cd0102eacb47439aa6efb2cac12e79
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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