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Sodium Ion → 4-Chloro-6-(4-chlorophenyl)pyrimidine

HRID 1215687
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HRID 1215687 반응식
[C:19](=[O:20])([O-:21])[O-:22].[CH3:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[Cl:1][c:2]1[n:3][cH:4][n:5][c:6]([Cl:8])[cH:7]1.[Cl:9][c:10]1[cH:11][cH:12][c:13]([B:16]([OH:17])[OH:18])[cH:14][cH:15]1.[Na+:23].[Na+:24].[OH2:25].[cH:33]1[cH:34][cH:35][c:36]([P:37]([Pd:38]([P:39]([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)([c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)([P:58]([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)([c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)[P:77]([c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)([c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)([c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)[c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)[cH:108][cH:109]1>>[c:2]1(-[c:13]2[cH:12][cH:11][c:10]([Cl:9])[cH:15][cH:14]2)[n:3][cH:4][n:5][c:6]([Cl:8])[cH:7]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 923Sodium Ion2회HCID 962WaterHCID 1140TolueneHCID 19660Carbonate IonHCID 709434,6-DichloropyrimidineHCID 742994-Chlorophenylboronic acidHCID 178420554HCID 178420554, 화합물

생성물 1

HCID 249020894-Chloro-6-(4-chlorophenyl)pyrimidine

출처 및 근거

ORD 기록
ord-f77660e5e10842549d59fcaad65d40e4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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