Toluene → HCID 178499208, compound

HRID 163495Notes

Reaction equation

HRID 163495 reaction equation
[C:1]([O:2][C:6](=[O:3])[NH:8][CH:9]([CH:10]([C:11](=[O:12])[O:13][CH3:14])[OH:15])[c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1)([CH3:4])([CH3:5])[CH3:7].[CH3:45][c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[O:22]=[CH:23][C:24]([Cl:25])([Cl:26])[Cl:27].[c:28]1([CH3:29])[cH:30][cH:31][c:32]([S:33]([O-:34])(=[O:35])=[O:36])[cH:37][cH:38]1.[nH+:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1>>[CH:6]1([C:24]([Cl:25])([Cl:26])[Cl:27])[NH:8][CH:9]([c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[CH:10]([C:11](=[O:12])[O:13][CH3:14])[O:15]1

Participants

6

Reactant 5

HCID 1140TolueneHCID 6407ChloralHCID 85570p-ToluenesulfonateHCID 4989215PyridiniumHCID 14565438HCID 14565438, compound

Product 1

HCID 178499208HCID 178499208, compound

Sources & evidence

ORD record
ord-37e5a25e3f4742ce8cc6bec05a376b0b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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