Ethanol → 7-(1,1-Dimethylethyl)-2-(pentafluoroethyl)-2H-1-benzopyran-3-carboxylic acid
Reaction equation
[CH2:29]1[O:30][CH2:31][CH2:32][CH2:33]1.[CH3:1][C:2]([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]2[c:8]([cH:25][cH:26]1)[CH:9]=[C:10]([C:20](=[O:21])[O:22][CH2:23][CH3:24])[CH:11]([C:13]([C:14]([F:15])([F:16])[F:17])([F:18])[F:19])[O:12]2.[CH3:34][CH2:35][OH:36].[Na+:28].[OH-:27]>>[CH3:1][C:2]([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]2[c:8]([cH:25][cH:26]1)[CH:9]=[C:10]([C:20](=[O:21])[OH:22])[CH:11]([C:13]([C:14]([F:15])([F:16])[F:17])([F:18])[F:19])[O:12]2Participants
6
Sources & evidence
- ORD record
- ord-8102d11c3fc64547ba92da865e7132e9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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