Water → HCID 178458714, compound

HRID 149367

Reaction equation

HRID 149367 reaction equation
[CH3:1][CH:2]1[C:3]2=[C:4]([C:5](=[O:6])[O:7][C:8]2=[O:9])[CH2:10][CH2:11][CH2:12]1.[CH3:26][N:27]([c:28]1[cH:29][cH:30][cH:31][cH:32][n:33]1)[CH3:34].[CH3:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[Cl:13][c:14]1[cH:15][c:16]([F:25])[c:17]([NH2:18])[cH:19][c:20]1[O:21][CH:22]([CH3:23])[CH3:24].[OH2:35]>>[CH3:1][CH:2]1[C:3]([C:8]([OH:7])=[O:9])=[C:4]([C:5]([OH:6])=[N:18][c:17]2[c:16]([F:25])[cH:15][c:14]([Cl:13])[c:20]([O:21][CH:22]([CH3:23])[CH3:24])[cH:19]2)[CH2:10][CH2:11][CH2:12]1

Participants

6

Reactant 5

HCID 962WaterHCID 1140TolueneHCID 218852-DimethylaminopyridineHCID 158649Benzenamine, 4-chloro-2-fluoro-5-(1-methylethoxy)-HCID 101301323-Methyl-3,4,5,6-tetrahydrophthalic acid anhydride

Product 1

HCID 178458714HCID 178458714, compound

Sources & evidence

ORD record
ord-641bee25b5d644778fc6130c807d73fa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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