Acetic Acid → HCID 178432356, compound

HRID 2140656Notes

Reaction equation

HRID 2140656 reaction equation
[CH3:29][C:30](=[O:31])[OH:32].[CH3:33][OH:34].[Cl:1][c:2]1[c:3]([NH:9][c:10]2[n:11][c:12]3[cH:13][c:14]([C:23](=[O:24])[O:25][CH3:26])[c:15]4[c:16]([n:17][c:18]([CH3:20])[o:19]4)[c:21]3[nH:22]2)[c:4]([Cl:8])[cH:5][cH:6][cH:7]1.[Na+:28].[OH-:27]>>[Cl:1][c:2]1[c:3]([NH:9][c:10]2[n:11][c:12]3[cH:13][c:14]([C:23](=[O:24])[OH:25])[c:15]4[c:16]([n:17][c:18]([CH3:20])[o:19]4)[c:21]3[nH:22]2)[c:4]([Cl:8])[cH:5][cH:6][cH:7]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 178496987HCID 178496987, compound

Product 1

HCID 178432356HCID 178432356, compound

Sources & evidence

ORD record
ord-82ca79c4718540d6b6c12b81ec2c389b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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