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Sodium Ion → Ethyl 3-[2-(tert-butoxycarbonylaminomethyl)phenyl]pyridine-2-carboxylate

HRID 1151097
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HRID 1151097 반응식
[Br:7][c:8]1[c:9]([C:14](=[O:15])[O:16][CH2:17][CH3:18])[n:10][cH:11][cH:12][cH:13]1.[C:19]([CH3:20])([CH3:21])([CH3:22])[O:23][C:24](=[O:25])[NH:26][CH2:27][c:28]1[c:29]([B:34]([OH:35])[OH:36])[cH:30][cH:31][cH:32][cH:33]1.[CH3:1][O:2][CH2:3][CH2:4][O:5][CH3:6].[Cl:43][CH2:44][Cl:45].[Na+:37].[Na+:38].[O-:39][C:40](=[O:41])[O-:42].[cH:46]1[cH:47][cH:48][c:49]([P:50]([Pd:51]([P:52]([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)([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)([P:71]([c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)([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)[P:90]([c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)([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)[cH:121][cH:122]1>>[c:8]1(-[c:29]2[c:28]([CH2:27][NH:26][C:24]([O:23][C:19]([CH3:20])([CH3:21])[CH3:22])=[O:25])[cH:33][cH:32][cH:31][cH:30]2)[c:9]([C:14](=[O:15])[O:16][CH2:17][CH3:18])[n:10][cH:11][cH:12][cH:13]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 923Sodium Ion2회HCID 6344DichloromethaneHCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 10911965(2-(((tert-Butoxycarbonyl)amino)methyl)phenyl)boronic acidHCID 15141568Ethyl 3-bromopyridine-2-carboxylate
HCID 178420554
HCID 178420554, 화합물

생성물 1

HCID 12017232Ethyl 3-[2-(tert-butoxycarbonylaminomethyl)phenyl]pyridine-2-carboxylate

출처 및 근거

ORD 기록
ord-2ab1fdf1448948b2b3e16561cb96093c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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