O-Xylene → HCID 12851824, compound

HRID 2139785Notes

Reaction equation

HRID 2139785 reaction equation
[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([C:8](=[O:9])[NH:10][CH2:11][CH2:12][c:13]2[c:14]([CH2:19][C:20]#[N:21])[cH:15][cH:16][cH:17][cH:18]2)[cH:22][cH:23]1.[P:32]([Cl:33])([Cl:34])([Cl:35])=[O:36].[c:24]1([CH3:25])[c:26]([CH3:27])[cH:28][cH:29][cH:30][cH:31]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([C:8]2=[N:10][CH2:11][CH2:12][c:13]3[c:14]([CH2:19][C:20]#[N:21])[cH:15][cH:16][cH:17][c:18]32)[cH:22][cH:23]1

Participants

4

Reactant 3

HCID 7237O-XyleneHCID 24813Phosphorus oxychlorideHCID 12851817HCID 12851817, compound

Product 1

HCID 12851824HCID 12851824, compound

Sources & evidence

ORD record
ord-0b560387bd6c4341afd63bc7b7b00401
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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