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].[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].[CH3:33][C:34]#[N:35].[K+:31].[K+:32].[OH2:36]>>[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:20]3[n:21][n:22][c:23]([C:25]#[N:26])[s:24]3)[cH:14][c:15]2[CH3:16])[B:9]([OH:11])[O:10]1)=[O:18]

Participants

Reactant 6

HCID 813Potassium Cation2×

HCID 962Water

HCID 6342Acetonitrile

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

Sources & evidence

ORD record: ord-251399e5a5e345b18f24e4bd9bc98ef1
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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