Hydrochloric Acid → 6-chloro-8-[(3-fluorophenyl)ethynyl]-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[C:6]1=[CH:15][c:14]2[c:9]([c:10]([C:17]#[C:18][c:19]3[cH:20][c:21]([F:25])[cH:22][cH:23][cH:24]3)[cH:11][c:12]([Cl:16])[cH:13]2)[O:8][CH:7]1[C:26]([F:27])([F:28])[F:29].[CH2:30]1[O:31][CH2:32][CH2:33][CH2:34]1.[CH3:35][CH2:36][OH:37].[ClH:39].[OH2:38].[OH2:40]>>[O:3]=[C:4]([OH:5])[C:6]1=[CH:15][c:14]2[c:9]([c:10]([C:17]#[C:18][c:19]3[cH:20][c:21]([F:25])[cH:22][cH:23][cH:24]3)[cH:11][c:12]([Cl:16])[cH:13]2)[O:8][CH:7]1[C:26]([F:27])([F:28])[F:29]Participants
6
Sources & evidence
- ORD record
- ord-3af7f5aee50d4bf1a97d808becf9ae92
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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