m-Ethynylphenol → HCID 53817841, compound
Reaction equation
[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[c:6]([SH:11])[cH:7][cH:8][cH:9][cH:10]1.[Na:21].[OH:12][c:13]1[cH:14][c:15]([C:19]#[CH:20])[cH:16][cH:17][cH:18]1>>[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[c:6]([S:11][CH:20]=[CH:19][c:15]2[cH:14][c:13]([OH:12])[cH:18][cH:17][cH:16]2)[cH:7][cH:8][cH:9][cH:10]1Participants
4
Sources & evidence
- ORD record
- ord-9e1e2410ff99456e8f933e96e0ae3ad9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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