Hydrochloric Acid → Ethyl 2-(6-(5-amino-1,3,4-thiadiazol-2-yloxy)-4-chloro-1-hydroxy-1,3-dihydro-benzo[c][1,2]oxaborol-3-yl)acetate

HRID 204346Notes

Reaction equation

HRID 204346 reaction equation
[CH3:28][CH2:29][OH:30].[Cl:1][c:2]1[cH:3][c:4]([O:18][c:19]2[s:20][c:21]([N+:24]([O-:25])=[O:26])[n:22][n:23]2)[cH:5][c:6]2[c:10]1[CH:9]([CH2:11][C:12](=[O:13])[O:14][CH2:15][CH3:16])[O:8][B:7]2[OH:17].[ClH:27].[OH2:31]>>[Cl:1][c:2]1[cH:3][c:4]([O:18][c:19]2[s:20][c:21]([NH2:24])[n:22][n:23]2)[cH:5][c:6]2[c:10]1[CH:9]([CH2:11][C:12](=[O:13])[O:14][CH2:15][CH3:16])[O:8][B:7]2[OH:17]

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 702EthanolHCID 962WaterHCID 58292595Ethyl 2-(4-chloro-1-hydroxy-6-(5-nitro-1,3,4-thiadiazol-2-yloxy)-1,3-dihydro-benzo[c][1,2]oxaborol-3-yl)acetate

Product 1

HCID 58292780Ethyl 2-(6-(5-amino-1,3,4-thiadiazol-2-yloxy)-4-chloro-1-hydroxy-1,3-dihydro-benzo[c][1,2]oxaborol-3-yl)acetate

Sources & evidence

ORD record
ord-7621ae4af58d4323844db38050e9dc3e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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