Toluene → HCID 86739161, compound

HRID 1120834Notes

Reaction equation

HRID 1120834 reaction equation
[C:1](#[N:2])[c:3]1[cH:4][c:5]([Br:11])[c:6]([OH:10])[c:7]([Br:9])[cH:8]1.[CH3:12][c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1.[CH3:19][CH2:20][N:21]([CH2:22][CH3:23])[CH2:24][CH3:25].[CH3:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH3:47].[CH:48]([OH:49])([CH3:50])[CH3:51].[Cl:26][CH:27]([C:28](=[O:29])[Cl:30])[O:31][N:32]=[CH:33][c:34]1[cH:35][cH:36][cH:37][cH:38][c:39]1[Cl:40]>>[C:1](#[N:2])[c:3]1[cH:4][c:5]([Br:11])[c:6]([O:10][C:28]([CH:27]([Cl:26])[O:31][N:32]=[CH:33][c:34]2[cH:35][cH:36][cH:37][cH:38][c:39]2[Cl:40])=[O:29])[c:7]([Br:9])[cH:8]1

Participants

7

Reactant 6

HCID 1140TolueneHCID 3776IsopropanolHCID 8471TriethylamineHCID 8900HeptaneHCID 15531BromoxynilHCID 86739160HCID 86739160, compound

Product 1

HCID 86739161HCID 86739161, compound

Sources & evidence

ORD record
ord-01b610f921654ecaa121887461d797ef
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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