Acetic Acid → HCID 67230080, compound
Reaction equation
[CH3:32][C:33](=[O:34])[OH:35].[CH3:37][CH2:38][OH:39].[Cl:1][c:2]1[cH:3][c:4](-[c:12]2[n:13][o:14][c:15](-[c:17]3[cH:18][cH:19][c:20]([CH:23]4[CH:24]([C:26](=[O:27])[O:28][CH3:29])[CH2:25]4)[cH:21][cH:22]3)[n:16]2)[cH:5][cH:6][c:7]1[O:8][CH:9]([CH3:10])[CH3:11].[ClH:36].[Na+:31].[OH-:30]>>[Cl:1][c:2]1[cH:3][c:4](-[c:12]2[n:13][o:14][c:15](-[c:17]3[cH:18][cH:19][c:20]([CH:23]4[CH:24]([C:26](=[O:27])[OH:28])[CH2:25]4)[cH:21][cH:22]3)[n:16]2)[cH:5][cH:6][c:7]1[O:8][CH:9]([CH3:10])[CH3:11]Participants
7
Sources & evidence
- ORD record
- ord-70fc5a2f50bc476eb42fec082615c4af
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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