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Chloride → Ethyl [3-(pyridin-3-yl)phenyl]acetate

HRID 690781
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HRID 690781 반응식
[Cl-:36].[F:1][C:2]([F:3])([F:4])[S:5]([O:6][c:7]1[cH:8][c:9]([CH2:13][C:14](=[O:15])[O:16][CH2:17][CH3:18])[cH:10][cH:11][cH:12]1)(=[O:19])=[O:20].[F:21][C:22]([F:23])([F:24])[S:25]([O:26][c:27]1[cH:28][n:29][cH:30][cH:31][cH:32]1)(=[O:33])=[O:34].[Li+:35].[O:37]1[CH2:38][CH2:39][O:40][CH2:41][CH2:42]1.[Pd:43].[c:101]1([P:102]([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)[cH:115][cH:116][cH:117][cH:118][cH:119]1.[c:44]1([P:45]([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)[cH:58][cH:59][cH:60][cH:61][cH:62]1.[c:63]1([P:64]([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)[cH:77][cH:78][cH:79][cH:80][cH:81]1.[c:82]1([P:83]([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)[cH:96][cH:97][cH:98][cH:99][cH:100]1>>[c:7]1(-[c:27]2[cH:28][n:29][cH:30][cH:31][cH:32]2)[cH:8][c:9]([CH2:13][C:14](=[O:15])[O:16][CH2:17][CH3:18])[cH:10][cH:11][cH:12]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 312ChlorideHCID 11776Triphenylphosphine4회HCID 23938PalladiumHCID 28486Lithium ionHCID 312751,4-DioxaneHCID 110315793-Pyridyl TrifluoromethanesulfonateHCID 14986694HCID 14986694, 화합물

생성물 1

HCID 14986695Ethyl [3-(pyridin-3-yl)phenyl]acetate

출처 및 근거

ORD 기록
ord-16b39d20d0054b29bd099483ceb5efa5
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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