Hydrochloric Acid → 3-[3-Fluoro-4-[3-(hydroxymethyl)-1,2-oxazol-5-yl]phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one

HRID 1144446Notes

Reaction equation

HRID 1144446 reaction equation
[BH4-:30].[CH3:33][S:34]([CH3:35])=[O:36].[CH3:40][OH:41].[Cl:37][CH2:38][Cl:39].[ClH:32].[F:1][c:2]1[c:3](-[c:20]2[cH:21][c:22]([C:25](=[O:26])[O:27][CH2:28][CH3:29])[n:23][o:24]2)[cH:4][cH:5][c:6]([N:8]2[C:9](=[O:19])[O:10][CH:11]([CH2:13][n:14]3[n:15][n:16][cH:17][cH:18]3)[CH2:12]2)[cH:7]1.[Li+:31]>>[F:1][c:2]1[c:3](-[c:20]2[cH:21][c:22]([CH2:25][OH:26])[n:23][o:24]2)[cH:4][cH:5][c:6]([N:8]2[C:9](=[O:19])[O:10][CH:11]([CH2:13][n:14]3[n:15][n:16][cH:17][cH:18]3)[CH2:12]2)[cH:7]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 679Dimethyl SulfoxideHCID 887MethanolHCID 6344DichloromethaneHCID 28123BorohydrideHCID 28486Lithium ionHCID 18438591Ethyl 5-[2-fluoro-4-[2-oxo-5-(triazol-1-ylmethyl)-1,3-oxazolidin-3-yl]phenyl]-1,2-oxazole-3-carboxylate

Product 1

HCID 184385893-[3-Fluoro-4-[3-(hydroxymethyl)-1,2-oxazol-5-yl]phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one

Sources & evidence

ORD record
ord-d3dfdc66a58c423b8523afd0124ed64b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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