Acetic Acid → HCID 178467226, compound

HRID 92305Notes

Reaction equation

HRID 92305 reaction equation
[CH3:41][C:42](=[O:43])[OH:44].[F:1][c:2]1[c:3]([C:12]([CH3:13])([OH:14])[c:15]2[n:16][cH:17][n:18]([C:20]([c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)([c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[cH:19]2)[cH:4][cH:5][cH:6][c:7]1[C:8]([F:9])([F:10])[F:11].[Na+:40].[OH-:39].[OH2:45]>>[F:1][c:2]1[c:3]([C:12]([CH3:13])([OH:14])[c:15]2[n:16][cH:17][nH:18][cH:19]2)[cH:4][cH:5][cH:6][c:7]1[C:8]([F:9])([F:10])[F:11]

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 592167011-(2-fluoro-3-trifluoromethyl-phenyl)-1-(1-trityl-1H-imidazol-4-yl)-ethanol

Product 1

HCID 178467226HCID 178467226, compound

Sources & evidence

ORD record
ord-b032f669afea48758a1d64805a2d25f1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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