Ammonium → HCID 76673623, compound

HRID 1121063Notes

Reaction equation

HRID 1121063 reaction equation
[CH3:27][OH:28].[CH3:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1.[Cl-:40].[Cl:29][c:30]1[cH:31][cH:32][c:33]([C:34](=[O:35])[O:36][CH3:37])[cH:38][cH:39]1.[F:1][c:2]1[cH:3][c:4]([CH:8]2[CH2:9][CH2:10][C:11](=[O:24])[N:12]2[c:13]2[cH:14][cH:15][c:16]([O:19][C:20]([F:21])([F:22])[F:23])[cH:17][cH:18]2)[cH:5][cH:6][cH:7]1.[H-:25].[NH4+:41].[Na+:26]>>[F:1][c:2]1[cH:3][c:4]([CH:8]2[CH2:9][CH:10]([C:34]([c:33]3[cH:32][cH:31][c:30]([Cl:29])[cH:39][cH:38]3)=[O:35])[C:11](=[O:24])[N:12]2[c:13]2[cH:14][cH:15][c:16]([O:19][C:20]([F:21])([F:22])[F:23])[cH:17][cH:18]2)[cH:5][cH:6][cH:7]1

Participants

9

Reactant 8

HCID 223AmmoniumHCID 312ChlorideHCID 887MethanolHCID 923Sodium ionHCID 1140TolueneHCID 14307Methyl 4-chlorobenzoateHCID 166653HydrideHCID 67499866HCID 67499866, compound

Product 1

HCID 76673623HCID 76673623, compound

Sources & evidence

ORD record
ord-677547aa039c44d39571b4606d4a5763
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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