Toluene → HCID 22379833, compound

HRID 142592Notes

Reaction equation

HRID 142592 reaction equation
[CH2:1]([CH3:2])[c:3]1[c:4]([C:13](=[O:14])[O:15][CH3:16])[cH:5][n:6]2[n:7][cH:8][nH:9][c:10](=[O:12])[c:11]12.[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[CH:17]([N:18]([CH:19]([CH3:20])[CH3:21])[CH2:22][CH3:23])([CH3:24])[CH3:25].[P:26]([Cl:27])([Cl:28])([Cl:29])=[O:30]>>[CH2:1]([CH3:2])[c:3]1[c:4]([C:13](=[O:14])[O:15][CH3:16])[cH:5][n:6]2[n:7][cH:8][n:9][c:10]([Cl:28])[c:11]12

Participants

5

Reactant 4

HCID 1140TolueneHCID 24813Phosphorus oxychlorideHCID 81531DiisopropylethylamineHCID 135740095Methyl 5-ethyl-1,4-dihydro-4-oxopyrrolo[2,1-f][1,2,4]triazine-6-carboxylate

Product 1

HCID 22379833HCID 22379833, compound

Sources & evidence

ORD record
ord-1b3d39b6ac6a478188101ac4b2e1c97e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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