Ethanol → HCID 67368383, compound

HRID 1233426Notes

Reaction equation

HRID 1233426 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[n:5]([cH:21]1)[CH2:6][C:7]1([c:14]3[n:15][cH:16][c:17]([CH3:20])[n:18][cH:19]3)[N:8]([C:9]2=[O:10])[CH2:11][CH2:12][NH:13]1.[CH3:37][O:38][CH2:39][CH2:40][O:41][CH3:42].[CH3:44][CH2:45][OH:46].[Na+:31].[Na+:32].[O-:33][C:34](=[O:35])[O-:36].[OH2:43].[Pd:47]([Cl:48])[Cl:49].[c:50]1([P:51]([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[cH:64][cH:65][cH:66][cH:67][cH:68]1.[c:69]1([P:70]([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)[c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[cH:83][cH:84][cH:85][cH:86][cH:87]1.[n:22]1[cH:23][c:24]([B:28]([OH:29])[OH:30])[cH:25][cH:26][cH:27]1>>[c:2]1(-[c:24]2[cH:23][n:22][cH:27][cH:26][cH:25]2)[cH:3][c:4]2[n:5]([cH:21]1)[CH2:6][C:7]1([c:14]3[n:15][cH:16][c:17]([CH3:20])[n:18][cH:19]3)[N:8]([C:9]2=[O:10])[CH2:11][CH2:12][NH:13]1

Participants

10

Reactant 9

HCID 702EthanolHCID 923Sodium ion2×HCID 962WaterHCID 80711,2-DimethoxyethaneHCID 11776Triphenylphosphine2×HCID 19660Carbonate IonHCID 24290Palladium ChlorideHCID 27343783-Pyridinylboronic acidHCID 67366902HCID 67366902, compound

Product 1

HCID 67368383HCID 67368383, compound

Sources & evidence

ORD record
ord-9aaa9a82e73a44f2a4bb5319cbd662c2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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