Toluene → HCID 86604822, compound

HRID 2146480Notes

Reaction equation

HRID 2146480 reaction equation
[CH2:1]([CH2:2][CH3:3])[c:4]1[cH:5][cH:6][c:7]([CH:10]=[CH:11][c:12]2[c:13](-[c:21]3[cH:22][cH:23][c:24]([CH2:27][CH2:28][CH2:29][CH2:30][CH3:31])[cH:25][cH:26]3)[c:14]([F:20])[c:15]([F:19])[c:16]([CH3:18])[cH:17]2)[cH:8][cH:9]1.[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[H:32][H:33]>>[CH2:1]([CH2:2][CH3:3])[c:4]1[cH:5][cH:6][c:7]([CH2:10][CH2:11][c:12]2[c:13](-[c:21]3[cH:22][cH:23][c:24]([CH2:27][CH2:28][CH2:29][CH2:30][CH3:31])[cH:25][cH:26]3)[c:14]([F:20])[c:15]([F:19])[c:16]([CH3:18])[cH:17]2)[cH:8][cH:9]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 86604823HCID 86604823, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 86604822HCID 86604822, compound

Sources & evidence

ORD record
ord-6efdd1203e9140739d2f0cd7af78c350
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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