Sodium ion → HCID 24897011, compound

HRID 121956Notes

Reaction equation

HRID 121956 reaction equation
[C:45](=[O:46])([O-:47])[O-:48].[CH2:92]1[O:93][CH2:94][CH2:95][CH2:96]1.[CH3:30][n:31]1[n:32][cH:33][c:34]([B:36]2[O:37][C:38]([CH3:39])([CH3:40])[C:41]([CH3:42])([CH3:43])[O:44]2)[cH:35]1.[I:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[CH2:9][CH2:10][c:11]3[c:12]([O:17][CH:18]4[CH2:19][CH2:20][N:21]([C:24](=[O:25])[O:26][CH:27]([CH3:28])[CH3:29])[CH2:22][CH2:23]4)[cH:13][cH:14][cH:15][c:16]32)[cH:6][cH:7]1.[Na+:49].[Na+:50].[Pd:51]([Cl:52])[Cl:53].[c:54]1([P:55]([c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)[c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)[cH:68][cH:69][cH:70][cH:71][cH:72]1.[c:73]1([P:74]([c:75]2[cH:76][cH:77][cH:78][cH:79][cH:80]2)[c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)[cH:87][cH:88][cH:89][cH:90][cH:91]1>>[c:2]1(-[c:34]2[cH:33][n:32][n:31]([CH3:30])[cH:35]2)[cH:3][cH:4][c:5]([N:8]2[CH2:9][CH2:10][c:11]3[c:12]([O:17][CH:18]4[CH2:19][CH2:20][N:21]([C:24](=[O:25])[O:26][CH:27]([CH3:28])[CH3:29])[CH2:22][CH2:23]4)[cH:13][cH:14][cH:15][c:16]32)[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 923Sodium ion2×HCID 8028TetrahydrofuranHCID 11776Triphenylphosphine2×HCID 19660Carbonate IonHCID 24290Palladium ChlorideHCID 27739871-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazoleHCID 68847313HCID 68847313, compound

Product 1

HCID 24897011HCID 24897011, compound

Sources & evidence

ORD record
ord-001d98f0cd814f638611b238f4e5143d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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