Hydrochloric Acid → HCID 123677397, compound

HRID 173748Notes

Reaction equation

HRID 173748 reaction equation
[CH3:37][O-:38].[CH3:41][OH:42].[CH:25](=[O:26])[c:27]1[cH:28][cH:29][c:30]([C:31](=[O:32])[O:33][CH3:34])[cH:35][cH:36]1.[Cl:8][c:9]1[cH:10][c:11]([NH:18][c:19]2[n:20][cH:21][cH:22][cH:23][cH:24]2)[c:12]([C:15]([CH3:16])=[O:17])[cH:13][cH:14]1.[ClH:40].[Na+:39].[OH2:43].[OH:1][C:2]([C:3]([F:4])([F:5])[F:6])=[O:7]>>[Cl:8][c:9]1[cH:10][c:11]([NH:18][c:19]2[n:20][cH:21][cH:22][cH:23][cH:24]2)[c:12]([C:15]([CH:16]=[CH:25][c:27]2[cH:28][cH:29][c:30]([C:31](=[O:32])[O:33][CH3:34])[cH:35][cH:36]2)=[O:17])[cH:13][cH:14]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium ionHCID 962WaterHCID 6422Trifluoroacetic acidHCID 15294Methyl 4-FormylbenzoateHCID 3826051MethoxideHCID 70816975HCID 70816975, compound

Product 1

HCID 123677397HCID 123677397, compound

Sources & evidence

ORD record
ord-e34f6f67c3a4429381a8a5132527a66c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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