Ethanol → HCID 13690976, compound

HRID 312259Notes

Reaction equation

HRID 312259 reaction equation
[CH3:30][CH2:31][OH:32].[F:1][c:2]1[cH:3][c:4]([CH:5]([CH3:6])[c:7]2[n:8][c:9]([CH2:12][S:13][CH3:14])[n:10][o:11]2)[cH:15][cH:16][c:17]1-[c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1.[I+3:24]([O-:25])([O-:26])([O-:27])[O-:28].[Na+:29].[OH2:33]>>[F:1][c:2]1[cH:3][c:4]([CH:5]([CH3:6])[c:7]2[n:8][c:9]([CH2:12][S:13]([CH3:14])=[O:25])[n:10][o:11]2)[cH:15][cH:16][c:17]1-[c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1

Participants

6

Sources & evidence

ORD record
ord-d9961bd22e574d31a5920dd61d1333f1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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