Sodium ion → HCID 66743166, compound

HRID 685096Notes

Reaction equation

HRID 685096 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]2[cH:8][n:9][n:10](-[c:17]3[c:18]([CH2:19][O:20][C:21]([CH3:22])=[O:23])[c:24]([B:28]4[O:29][C:30]([CH3:31])([CH3:32])[C:33]([CH3:34])([CH3:35])[O:36]4)[cH:25][cH:26][cH:27]3)[c:11](=[O:16])[c:12]2[c:13]([F:15])[cH:14]1.[Cl:43][c:44]1[cH:45][c:46]([Si:52]([CH3:53])([CH3:54])[CH3:55])[c:47](=[O:51])[n:48]([CH3:50])[n:49]1.[I:56][c:57]1[cH:58][c:59]([Si:60]([CH3:61])([CH3:62])[CH3:63])[c:64](=[O:65])[n:66]([CH3:67])[n:68]1.[Na+:37].[Na+:38].[O-:39][C:40](=[O:41])[O-:42].[O:69]1[CH2:70][CH2:71][O:72][CH2:73][CH2:74]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]2[cH:8][n:9][n:10](-[c:17]3[c:18]([CH2:19][O:20][C:21]([CH3:22])=[O:23])[c:24](-[c:44]4[cH:45][c:46]([Si:52]([CH3:53])([CH3:54])[CH3:55])[c:47](=[O:51])[n:48]([CH3:50])[n:49]4)[cH:25][cH:26][cH:27]3)[c:11](=[O:16])[c:12]2[c:13]([F:15])[cH:14]1

Participants

7

Reactant 6

HCID 923Sodium ion2×HCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 594737692-(6-(tert-Butyl)-8-fluoro-1-oxophthalazin-2(1H)-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl acetateHCID 66742985HCID 66742985, compoundHCID 66743378HCID 66743378, compound

Product 1

HCID 66743166HCID 66743166, compound

Sources & evidence

ORD record
ord-462f5a65d3c9457a8732edd10746adba
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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