Acetic Acid → HCID 13457722, compound

HRID 319537Notes

Reaction equation

HRID 319537 reaction equation
[BrH:1].[CH3:22][C:23](=[O:24])[OH:25].[CH3:2][N:3]([C:4]([CH2:5][NH2:6])=[O:7])[n:8]1[c:9]([C:13]([c:14]2[c:15]([Cl:20])[cH:16][cH:17][cH:18][cH:19]2)=[O:21])[cH:10][cH:11][cH:12]1.[CH:26]([OH:27])([CH3:28])[CH3:29]>>[CH3:2][N:3]1[C:4](=[O:7])[CH2:5][N:6]=[C:13]([c:14]2[c:15]([Cl:20])[cH:16][cH:17][cH:18][cH:19]2)[c:9]2[n:8]1[cH:12][cH:11][cH:10]2

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 260Hydrogen BromideHCID 3776IsopropanolHCID 13457757HCID 13457757, compound

Product 1

HCID 13457722HCID 13457722, compound

Sources & evidence

ORD record
ord-c5be19088aab42368e97b4d0bf1f18f1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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