Hydrochloric Acid → [1-Hydroxy-4-methyl-6-(pyrazin-2-yloxy)-1,3-dihydro-benzo[c][1,2]oxaborol-3-yl]-acetic acid ethyl ester

Reaction equation

[C:19](=[O:20])([O-:21])[O-:22].[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH:6]1[c:7]2[c:8]([cH:12][c:13]([OH:17])[cH:14][c:15]2[CH3:16])[B:9]([OH:11])[O:10]1)=[O:18].[Cl:25][c:26]1[n:27][cH:28][cH:29][n:30][cH:31]1.[ClH:32].[Cs+:23].[Cs+:24].[O:33]=[CH:34][N:35]([CH3:36])[CH3:37]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH:6]1[c:7]2[c:8]([cH:12][c:13]([O:17][c:26]3[n:27][cH:28][cH:29][n:30][cH:31]3)[cH:14][c:15]2[CH3:16])[B:9]([OH:11])[O:10]1)=[O:18]

Participants

Reactant 6

HCID 313Hydrochloric Acid

HCID 6228Dimethylformamide

HCID 19660Carbonate Ion

HCID 73277Chloropyrazine

HCID 104967Cesium cation2×

HCID 58292549Ethyl 2-(1,6-dihydroxy-4-methyl-1,3-dihydrobenzo[c][1,2]oxaborol-3-yl)acetate

Product 1

Sources & evidence

ORD record: ord-9d3539e897904f0fb26c7e358af563c6
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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