Acetic Acid → HCID 178478148, compound

HRID 1151501Notes

Reaction equation

HRID 1151501 reaction equation
[CH3:19][C:20](=[O:21])[OH:22].[CH3:36][OH:37].[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-[c:28]1[c:29]([CH:30]=[O:31])[cH:32][cH:33][cH:34][cH:35]1>>[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:30][c:29]1[c:28](-[c:27]2[nH:23][n:24][n:25][n:26]2)[cH:35][cH:34][cH:33][cH:32]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 887MethanolHCID 178509242HCID 178509242, compoundHCID 178519511HCID 178519511, compound

Product 1

HCID 178478148HCID 178478148, compound

Sources & evidence

ORD record
ord-fc58d59e0b184bb989b191cdeefd5071
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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