Toluene → HCID 19436797, compound

HRID 212166Notes

Reaction equation

HRID 212166 reaction equation
[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[Cl:14][c:15]1[n:16][n:17][cH:18][c:19]([O:21][CH3:22])[cH:20]1.[OH:1][c:2]1[c:3]([CH:12]=[O:13])[c:4]([C:8]([F:9])([F:10])[F:11])[n:5][n:6]1[CH3:7].[n:23]1[c:24]([CH3:25])[cH:26][cH:27][cH:28][c:29]1[CH3:30]>>[O:1]([c:2]1[c:3]([CH:12]=[O:13])[c:4]([C:8]([F:9])([F:10])[F:11])[n:5][n:6]1[CH3:7])[c:15]1[n:16][n:17][cH:18][c:19]([O:21][CH3:22])[cH:20]1

Participants

5

Sources & evidence

ORD record
ord-e72d1a4e127d4d6c9f868968078ba739
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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