Acetic Acid → HCID 23795519, compound

HRID 165687Notes

Reaction equation

HRID 165687 reaction equation
[CH3:34][C:35](=[O:36])[OH:37].[K:1][O:2][C:3]#[N:4].[NH2:5][c:6]1[cH:7][c:8]([CH:22]([CH3:23])[CH2:24][CH2:25][CH2:26][c:27]2[cH:28][cH:29][c:30]([F:33])[cH:31][cH:32]2)[cH:9][c:10]2[c:11]1-[c:12]1[cH:13][n:14][cH:15][cH:16][c:17]1[C:18]([CH3:20])([CH3:21])[O:19]2.[OH2:38]>>[O:2]=[C:3]([NH2:4])[NH:5][c:6]1[cH:7][c:8]([CH:22]([CH3:23])[CH2:24][CH2:25][CH2:26][c:27]2[cH:28][cH:29][c:30]([F:33])[cH:31][cH:32]2)[cH:9][c:10]2[c:11]1-[c:12]1[cH:13][n:14][cH:15][cH:16][c:17]1[C:18]([CH3:20])([CH3:21])[O:19]2

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 20309733HCID 20309733, compoundHCID 178418250HCID 178418250, compound

Product 1

HCID 23795519HCID 23795519, compound

Sources & evidence

ORD record
ord-c338739e8ae34db4aa958d03418022bc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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