Sodium ion → HCID 67318017, compound

HRID 1201178Notes

Reaction equation

HRID 1201178 reaction equation
[Br:1][c:2]1[cH:3][c:4]([Cl:22])[c:5]([CH2:6][CH:7]2[C:8](=[O:19])[N:9]([CH:12]3[CH2:13][CH2:14][C:15](=[O:18])[CH2:16][CH2:17]3)[CH2:10][CH2:11]2)[cH:20][cH:21]1.[CH3:23][n:24]1[n:25][cH:26][c:27]([B:29]2[O:30][C:31]([CH3:32])([CH3:33])[C:34]([CH3:35])([CH3:36])[O:37]2)[cH:28]1.[CH3:44][O:45][CH2:46][CH2:47][O:48][CH3:49].[CH3:50][CH2:51][O:52][C:53]([CH3:54])=[O:55].[Na+:38].[Na+:39].[O-:40][C:41](=[O:42])[O-:43].[OH2:56]>>[c:2]1(-[c:27]2[cH:26][n:25][n:24]([CH3:23])[cH:28]2)[cH:3][c:4]([Cl:22])[c:5]([CH2:6][CH:7]2[C:8](=[O:19])[N:9]([CH:12]3[CH2:13][CH2:14][C:15](=[O:18])[CH2:16][CH2:17]3)[CH2:10][CH2:11]2)[cH:20][cH:21]1

Participants

8

Reactant 7

HCID 923Sodium ion2×HCID 962WaterHCID 80711,2-DimethoxyethaneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 27739871-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazoleHCID 57671390HCID 57671390, compound

Product 1

HCID 67318017HCID 67318017, compound

Sources & evidence

ORD record
ord-ffc9ca6d159b4a2c8fc7ac03ad0fb722
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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