Toluene → HCID 23052547, compound

HRID 668663Notes

Reaction equation

HRID 668663 reaction equation
[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[Cl:14][c:15]1[c:16]([NH2:17])[cH:18][c:19]([Cl:30])[c:20]([O:22][C:23]([C:24]([F:25])([F:26])[F:27])([F:28])[F:29])[cH:21]1.[F:1][c:2]1[c:3]([C:4](=[O:5])[N:6]=[C:7]=[O:8])[c:9]([F:13])[cH:10][cH:11][cH:12]1>>[F:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][C:7](=[O:8])[NH:17][c:16]2[c:15]([Cl:14])[cH:21][c:20]([O:22][C:23]([C:24]([F:25])([F:26])[F:27])([F:28])[F:29])[c:19]([Cl:30])[cH:18]2)[c:9]([F:13])[cH:10][cH:11][cH:12]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 27333692,6-Difluorobenzoyl isocyanateHCID 23052545HCID 23052545, compound

Product 1

HCID 23052547HCID 23052547, compound

Sources & evidence

ORD record
ord-6f7ac73a4c77420cabeb5a486573fead
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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