Acetate → HCID 59351245, compound

HRID 1148192Notes

Reaction equation

HRID 1148192 reaction equation
[C:26]([CH3:27])([CH3:28])([CH3:29])[Si:30]([O:31][CH:32]1[CH2:33][CH:34]=[C:35]([B:38]2[O:39][C:40]([CH3:41])([CH3:42])[C:43]([CH3:44])([CH3:45])[O:46]2)[CH2:36][CH2:37]1)([CH3:47])[CH3:48].[CH3:50][C:51](=[O:52])[O-:53].[CH3:55][C:56]#[N:57].[K+:49].[OH2:54].[nH:1]1[c:2]([C:10](=[O:11])[c:12]2[cH:13][cH:14][c:15]([O:18][c:19]3[n:20][cH:21][cH:22][n:23][c:24]3[Cl:25])[cH:16][cH:17]2)[n:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2>>[nH:1]1[c:2]([C:10](=[O:11])[c:12]2[cH:13][cH:14][c:15]([O:18][c:19]3[n:20][cH:21][cH:22][n:23][c:24]3[C:35]3=[CH:34][CH2:33][CH:32]([O:31][Si:30]([C:26]([CH3:27])([CH3:28])[CH3:29])([CH3:47])[CH3:48])[CH2:37][CH2:36]3)[cH:16][cH:17]2)[n:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2

Participants

7

Reactant 6

HCID 175AcetateHCID 813Potassium CationHCID 962WaterHCID 6342AcetonitrileHCID 46207940(4-(3-chloropyrazin-2-yloxy)phenyl)(1H-benzo[d]imidazol-2-yl)methanoneHCID 53393368Tert-butyldimethyl((4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclohex-3-en-1-yl)oxy)silane

Product 1

HCID 59351245HCID 59351245, compound

Sources & evidence

ORD record
ord-2498383b1d804b9cbbeebf87520d1a83
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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