Acetate → HCID 178515365, compound

HRID 675992Notes

Reaction equation

HRID 675992 reaction equation
[CH3:21][C:22]([O-:23])=[O:24].[CH3:25][c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1.[CH3:32][C:33](=[O:34])[OH:35].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9](=[O:19])[n:10](-[c:13]3[n:14][cH:15][cH:16][cH:17][cH:18]3)[nH:11][cH:12]2)[cH:6][n:7]1.[NH4+:20]>>[c:2]1([OH:23])[cH:3][cH:4][c:5](-[c:8]2[c:9](=[O:19])[n:10](-[c:13]3[n:14][cH:15][cH:16][cH:17][cH:18]3)[nH:11][cH:12]2)[cH:6][n:7]1

Participants

6

Reactant 5

HCID 175AcetateHCID 176Acetic AcidHCID 223AmmoniumHCID 1140TolueneHCID 59186978HCID 59186978, compound

Product 1

HCID 178515365HCID 178515365, compound

Sources & evidence

ORD record
ord-c1613a82b2de4d6ba94015b98c04efcf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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