Triphenylphosphine → 1-{4'-[4-(2-Benzyloxy-1-hydroxy-ethyl)-3-methyl-isoxazol-5-yl]-biphenyl-4-yl}-cyclopropanecarboxylic acid ethyl ester

HRID 1543649Notes

Reaction equation

HRID 1543649 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][CH2:9][CH:10]([OH:11])[c:12]1[c:13]([CH3:24])[n:14][o:15][c:16]1-[c:17]1[cH:18][cH:19][c:20]([Br:23])[cH:21][cH:22]1.[CH2:25]([CH3:26])[O:27][C:28](=[O:29])[C:30]1([c:33]2[cH:34][cH:35][c:36]([B:39]3[O:40][C:41]([CH3:42])([CH3:43])[C:44]([CH3:45])([CH3:46])[O:47]3)[cH:37][cH:38]2)[CH2:31][CH2:32]1.[Pd:48]([Cl:49])[Cl:50].[c:51]1([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)[cH:65][cH:66][cH:67][cH:68][cH:69]1.[c:70]1([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)[cH:84][cH:85][cH:86][cH:87][cH:88]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][CH2:9][CH:10]([OH:11])[c:12]1[c:13]([CH3:24])[n:14][o:15][c:16]1-[c:17]1[cH:18][cH:19][c:20](-[c:36]2[cH:35][cH:34][c:33]([C:30]3([C:28]([O:27][CH2:25][CH3:26])=[O:29])[CH2:31][CH2:32]3)[cH:38][cH:37]2)[cH:21][cH:22]1

Participants

5

Reactant 4

HCID 11776Triphenylphosphine2×HCID 24290Palladium ChlorideHCID 53217182Ethyl 1-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)cyclopropanecarboxylateHCID 665773582-Benzyloxy-1-[5-(4-bromo-phenyl)-3-methyl-isoxazol-4-yl]ethanol

Product 1

HCID 665773241-{4'-[4-(2-Benzyloxy-1-hydroxy-ethyl)-3-methyl-isoxazol-5-yl]-biphenyl-4-yl}-cyclopropanecarboxylic acid ethyl ester

Sources & evidence

ORD record
ord-5c54e88fbec84d9dadadd4ac83291431
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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