Toluene → HCID 22605396, compound

HRID 2321355Notes

Reaction equation

HRID 2321355 reaction equation
[C:26]([OH:27])([CH3:28])([CH3:29])[CH3:30].[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[F:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([Cl:25])[CH2:9][N:10]([CH:12]([c:13]3[cH:14][cH:15][cH:16][cH:17][cH:18]3)[c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[CH2:11]2)[cH:6][cH:7]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[CH2:9][N:10]([CH:12]([c:13]3[cH:14][cH:15][cH:16][cH:17][cH:18]3)[c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[CH2:11]2)[cH:6][cH:7]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 6386tert-ButanolHCID 22605405HCID 22605405, compound

Product 1

HCID 22605396HCID 22605396, compound

Sources & evidence

ORD record
ord-86b4dd8637ee40a6b73f5e05a2afa8b1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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