Acetic Acid → HCID 178478158, compound

HRID 291867Notes

Reaction equation

HRID 291867 reaction equation
[CH3:19][C:20](=[O:21])[OH:22].[CH3:30][OH:31].[NH2:1][c:2]1[n:3][nH:4][c:5]2[n:6][cH:7][n:8][c:9]([NH:11][c:12]3[cH:13][c:14]([Cl:18])[cH:15][cH:16][cH:17]3)[c:10]12.[nH:23]1[n:24][n:25][n:26][c:27]1[CH:28]=[O:29]>>[N:1]([c:2]1[n:3][nH:4][c:5]2[n:6][cH:7][n:8][c:9]([NH:11][c:12]3[cH:13][c:14]([Cl:18])[cH:15][cH:16][cH:17]3)[c:10]12)=[CH:28][c:27]1[n:23][n:24][n:25][nH:26]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 887MethanolHCID 178509242HCID 178509242, compoundHCID 178520064HCID 178520064, compound

Product 1

HCID 178478158HCID 178478158, compound

Sources & evidence

ORD record
ord-3b9c3d26a09d45139030fe6bb5638757
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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