Acetic Acid → HCID 19610579, compound

HRID 318327Notes

Reaction equation

HRID 318327 reaction equation
[CH3:19][C:20](=[O:21])[OH:22].[CH3:23][O:24][C:25]([c:26]1[cH:27][c:28]([CH:32]=[O:33])[cH:29][cH:30][cH:31]1)=[O:34].[CH3:35][OH:36].[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: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)[CH2:32][c:28]1[cH:27][c:26]([C:25]([O:24][CH3:23])=[O:34])[cH:31][cH:30][cH:29]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 887MethanolHCID 639145Methyl 3-formylbenzoateHCID 178509242HCID 178509242, compound

Product 1

HCID 19610579HCID 19610579, compound

Sources & evidence

ORD record
ord-9ac7c65511954ce591b049c90ed3d5c0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…