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

HRID 316435Notes

Reaction equation

HRID 316435 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([CH:14]([CH:15]=[CH2:16])[OH:17])[c:10]([CH3:13])[n:11][o:12]2)[cH:6][cH:7]1.[CH2:18]([CH3:19])[O:20][C:21](=[O:22])[C:23]1([c:26]2[cH:27][cH:28][c:29]([B:32]3[O:33][C:34]([CH3:35])([CH3:36])[C:37]([CH3:38])([CH3:39])[O:40]3)[cH:30][cH:31]2)[CH2:24][CH2:25]1.[Pd:41]([Cl:42])[Cl:43].[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:2]1(-[c:29]2[cH:28][cH:27][c:26]([C:23]3([C:21]([O:20][CH2:18][CH3:19])=[O:22])[CH2:24][CH2:25]3)[cH:31][cH:30]2)[cH:3][cH:4][c:5](-[c:8]2[c:9]([CH:14]([CH:15]=[CH2:16])[OH:17])[c:10]([CH3:13])[n:11][o:12]2)[cH:6][cH:7]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 665821121-[5-(4-Bromo-phenyl)-3-methyl-isoxazol-4-yl]prop-2-en-1-ol

Product 1

HCID 665773291-{4'-[4-(1-Hydroxy-allyl)-3-methyl-isoxazol-5-yl]-biphenyl-4-yl}-cyclopropanecarboxylic acid ethyl ester

Sources & evidence

ORD record
ord-3c9ebde6311f40fea8ee4b234f038122
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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