O-Xylene → HCID 58958171, compound

HRID 2124907Notes

Reaction equation

HRID 2124907 reaction equation
[CH2:1]1[N:2]([CH2:11][C:12](=[O:13])[NH:14][NH2:15])[CH2:3][CH2:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]21.[CH3:16][Al:17]([CH3:18])[CH3:19].[CH3:20][c:21]1[n:22][c:23]2[cH:24][cH:25][cH:26][cH:27][c:28]2[c:29]([NH:31][c:32]2[cH:33][c:34]([C:35](=[O:36])[O:37][CH3:38])[cH:39][cH:40][cH:41]2)[cH:30]1.[c:42]1([CH3:43])[c:44]([CH3:45])[cH:46][cH:47][cH:48][cH:49]1>>[CH2:1]1[N:2]([CH2:11][C:12](=[O:13])[NH:14][NH:15][C:35]([c:34]2[cH:33][c:32]([NH:31][c:29]3[c:28]4[c:23]([n:22][c:21]([CH3:20])[cH:30]3)[cH:24][cH:25][cH:26][cH:27]4)[cH:41][cH:40][cH:39]2)=[O:36])[CH2:3][CH2:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]21

Participants

5

Reactant 4

HCID 7237O-XyleneHCID 719836HCID 719836, compoundHCID 16682925TrimethylaluminumHCID 27055575HCID 27055575, compound

Product 1

HCID 58958171HCID 58958171, compound

Sources & evidence

ORD record
ord-f4efd1c7c98e4b65b2aa08c30d80aec1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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