Ethanol → HCID 12687119, compound
Reaction equation
[Al+3:2].[CH3:25][CH2:26][OH:27].[Cl:7][c:8]1[cH:9][cH:10][cH:11][c:12]2[c:13]1[CH2:14][CH:15]([Cl:24])[c:16]1[c:17]([cH:19][cH:20][c:21]([F:23])[cH:22]1)[S:18]2.[H-:1].[H-:4].[H-:5].[H-:6].[Li+:3].[O:29]1[CH2:30][CH2:31][CH2:32][CH2:33]1.[OH2:28]>>[Cl:7][c:8]1[cH:9][cH:10][cH:11][c:12]2[c:13]1[CH2:14][CH2:15][c:16]1[c:17]([cH:19][cH:20][c:21]([F:23])[cH:22]1)[S:18]2Participants
8
Sources & evidence
- ORD record
- ord-f516a28f4a214d34af49e08ff5fdcbca
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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