Potassium Cation → Ethyl 2-(6-(5-cyano-1,3,4-thiadiazol-2-yloxy)-1-hydroxy-4-methyl-1,3-dihydrobenzo[c][1,2]oxaborol-3-yl)acetate

Reaction equation

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

Participants

Reactant 4

HCID 813Potassium Cation2×

HCID 19660Carbonate Ion

HCID 533885265-Bromo-1,3,4-thiadiazole-2-carbonitrile

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

Product 1

HCID 67252448Ethyl 2-(6-(5-cyano-1,3,4-thiadiazol-2-yloxy)-1-hydroxy-4-methyl-1,3-dihydrobenzo[c][1,2]oxaborol-3-yl)acetate

Sources & evidence

ORD record: ord-b0dcdc23636f44d3b0b5451d3de2ec1c
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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