Acetic Acid → 2-(4-Methyl-benzyl)-5-(2-nitro-ethyl)-thiophene
Reaction equation
[BH4-:27].[CH3:1][S:2](=[O:3])[CH3:4].[CH3:23][C:24](=[O:25])[OH:26].[CH3:5][c:6]1[cH:7][cH:8][c:9]([CH2:10][c:11]2[s:12][c:13]([CH:16]=[CH:17][N+:18](=[O:19])[O-:20])[cH:14][cH:15]2)[cH:21][cH:22]1.[Na+:28].[OH2:29]>>[CH3:5][c:6]1[cH:7][cH:8][c:9]([CH2:10][c:11]2[s:12][c:13]([CH2:16][CH2:17][N+:18](=[O:19])[O-:20])[cH:14][cH:15]2)[cH:21][cH:22]1Participants
7
Sources & evidence
- ORD record
- ord-805cbe146fd2419499c8d9f9dcff497b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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