Sodium ion → HCID 11443047, compound

HRID 2317966Notes

Reaction equation

HRID 2317966 reaction equation
[Br:35][c:36]1[cH:37][cH:38][c:39]([C:40](=[C:41]2[CH2:42][C:43]([CH3:44])([CH3:45])[CH2:46][C:47]([CH3:48])([CH3:49])[CH2:50]2)[c:51]2[cH:52][cH:53][c:54]([OH:55])[cH:56][cH:57]2)[cH:58][cH:59]1.[C:75](=[O:76])([O-:77])[O-:78].[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8](-[c:11]2[cH:12][cH:13][c:14]([C:17]([c:18]3[cH:19][cH:20][c:21]([OH:24])[cH:22][cH:23]3)=[C:25]3[CH2:26][C:27]([CH3:33])([CH3:34])[CH2:28][C:29]([CH3:31])([CH3:32])[CH2:30]3)[cH:15][cH:16]2)[cH:9][cH:10]1.[Na+:79].[Na+:80].[O:60]1[CH2:61][CH2:62][N:63]([c:66]2[cH:67][cH:68][c:69]([B:70]([OH:71])[OH:72])[cH:73][cH:74]2)[CH2:64][CH2:65]1.[OH2:122].[Pd:81]([Cl:82])[Cl:83].[c:103]1([P:104]([c:105]2[cH:106][cH:107][cH:108][cH:109][cH:110]2)[c:111]2[cH:112][cH:113][cH:114][cH:115][cH:116]2)[cH:117][cH:118][cH:119][cH:120][cH:121]1.[c:84]1([P:85]([c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)[c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)[cH:98][cH:99][cH:100][cH:101][cH:102]1>>[c:5]1([N:63]2[CH2:62][CH2:61][O:60][CH2:65][CH2:64]2)[cH:6][cH:7][c:8](-[c:11]2[cH:12][cH:13][c:14]([C:17]([c:18]3[cH:19][cH:20][c:21]([OH:24])[cH:22][cH:23]3)=[C:25]3[CH2:26][C:27]([CH3:33])([CH3:34])[CH2:28][C:29]([CH3:31])([CH3:32])[CH2:30]3)[cH:15][cH:16]2)[cH:9][cH:10]1

Participants

9

Reactant 8

HCID 923Sodium ion2×HCID 962WaterHCID 11776Triphenylphosphine2×HCID 19660Carbonate IonHCID 24290Palladium ChlorideHCID 2795359(4-(Morpholin-4-yl)phenyl)boronic acidHCID 111557414-[[4'-(Methylsulfonyl)-4-biphenylyl](3,3,5,5-tetramethylcyclohexylidene)methyl]phenolHCID 686543984-[(4-Bromophenyl)(3,3,5,5-tetramethylcyclohexylidene)methyl]phenol

Product 1

HCID 11443047HCID 11443047, compound

Sources & evidence

ORD record
ord-3cd6851cf21043ee9433e2a9f332775f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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