Toluene → HCID 21833021, compound

HRID 664655Notes

Reaction equation

HRID 664655 reaction equation
[CH3:1][N:2]([CH2:3][CH2:4][N:5]1[CH2:6][CH2:7][O:8][c:9]2[c:10]1[cH:11][c:12]1[c:13]([cH:14]2)[CH2:15][CH2:16][CH2:17][NH:18]1)[CH3:19].[CH3:20][Al:21]([CH3:22])[CH3:23].[CH3:24][c:25]1[c:26](-[c:37]2[cH:38][cH:39][c:40]([C:43](=[O:44])[O:45][CH3:46])[cH:41][cH:42]2)[cH:27][cH:28][c:29]([N:31]2[C:32](=[O:36])[CH2:33][CH2:34][CH2:35]2)[cH:30]1.[CH3:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1>>[CH3:1][N:2]([CH2:3][CH2:4][N:5]1[CH2:6][CH2:7][O:8][c:9]2[c:10]1[cH:11][c:12]1[c:13]([cH:14]2)[CH2:15][CH2:16][CH2:17][N:18]1[C:43]([c:40]1[cH:39][cH:38][c:37](-[c:26]2[c:25]([CH3:24])[cH:30][c:29]([N:31]3[C:32](=[O:36])[CH2:33][CH2:34][CH2:35]3)[cH:28][cH:27]2)[cH:42][cH:41]1)=[O:44])[CH3:19]

Participants

5

Reactant 4

HCID 1140TolueneHCID 10990514HCID 10990514, compoundHCID 10999839HCID 10999839, compoundHCID 16682925Trimethylaluminum

Product 1

HCID 21833021HCID 21833021, compound

Sources & evidence

ORD record
ord-b63f490240d647f6ad4dfad3047d492f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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