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Potassium Cation → HCID 76167157, 화합물

HRID 1565191
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인쇄 미리보기

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HRID 1565191 반응식
[Br:1][c:2]1[cH:3][c:4]2[c:5]([n:6][cH:7]1)[nH:8][cH:9][c:10]2[CH:11]([CH3:12])[c:13]1[c:14]([Cl:22])[c:15]([F:21])[cH:16][cH:17][c:18]1[O:19][CH3:20].[CH3:23][c:24]1[n:25][n:26]([CH:38]2[CH2:39][CH2:40][CH:41]([C:44](=[O:45])[O:46][CH2:47][CH3:48])[CH2:42][CH2:43]2)[cH:27][c:28]1[B:29]1[O:30][C:31]([CH3:32])([CH3:33])[C:34]([CH3:35])([CH3:36])[O:37]1.[F-:49].[K+:50].[O:129]1[CH2:130][CH2:131][O:132][CH2:133][CH2:134]1.[OH2:51].[cH:52]1[cH:53][cH:54][c:55]([P:56]([Pd:57]([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)[P:96]([c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)([c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)[c:109]2[cH:110][cH:111][cH:112][cH:113][cH:114]2)([c:115]2[cH:116][cH:117][cH:118][cH:119][cH:120]2)[c:121]2[cH:122][cH:123][cH:124][cH:125][cH:126]2)[cH:127][cH:128]1>>[c:2]1(-[c:28]2[c:24]([CH3:23])[n:25][n:26]([CH:38]3[CH2:39][CH2:40][CH:41]([C:44](=[O:45])[O:46][CH2:47][CH3:48])[CH2:42][CH2:43]3)[cH:27]2)[cH:3][c:4]2[c:5]([n:6][cH:7]1)[nH:8][cH:9][c:10]2[CH:11]([CH3:12])[c:13]1[c:14]([Cl:22])[c:15]([F:21])[cH:16][cH:17][c:18]1[O:19][CH3:20]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 813Potassium CationHCID 962WaterHCID 28179Fluoride IonHCID 312751,4-DioxaneHCID 67004029HCID 67004029, 화합물HCID 670045715-bromo-3-[1-(2-chloro-3-fluoro-6-methoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]pyridineHCID 178420554
HCID 178420554, 화합물

생성물 1

HCID 76167157HCID 76167157, 화합물

출처 및 근거

ORD 기록
ord-8dce3af7c05548529340f7f7edd6e495
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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