Toluene → Diclofenac

HRID 2141660Notes

Reaction equation

HRID 2141660 reaction equation
[CH2:8]([c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)[N:15]([c:16]1[c:17]([Cl:23])[cH:18][cH:19][cH:20][c:21]1[Cl:22])[c:24]1[c:25]([CH2:30][C:31](=[O:32])[OH:33])[cH:26][cH:27][cH:28][cH:29]1.[CH3:1][c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1.[Cl:34][c:35]1[cH:36][cH:37][cH:38][cH:39][c:40]1[Cl:41]>>[NH:15]([c:16]1[c:17]([Cl:23])[cH:18][cH:19][cH:20][c:21]1[Cl:22])[c:24]1[c:25]([CH2:30][C:31](=[O:32])[OH:33])[cH:26][cH:27][cH:28][cH:29]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 72391,2-DichlorobenzeneHCID 13023173HCID 13023173, compound

Product 1

HCID 3033Diclofenac

Sources & evidence

ORD record
ord-46ecbb0c4c2d49d6b3ae9558f0b1f75f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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