Acetic Acid → HCID 69221288, compound

HRID 182048Notes

Reaction equation

HRID 182048 reaction equation
[CH3:1][O:2][c:3]1[c:4]([N+:22]([O-:23])=[O:24])[c:5]2[c:6]([n:7][c:8](-[c:10]3[cH:11][c:12]4[cH:13][cH:14][cH:15][cH:16][c:17]4[cH:18][cH:19]3)[s:9]2)[cH:20][cH:21]1.[CH3:27][OH:28].[CH3:29][C:30](=[O:31])[OH:32].[H:25][H:26]>>[CH3:1][O:2][c:3]1[c:4]([NH2:22])[c:5]2[c:6]([n:7][c:8](-[c:10]3[cH:11][c:12]4[cH:13][cH:14][cH:15][cH:16][c:17]4[cH:18][cH:19]3)[s:9]2)[cH:20][cH:21]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 887MethanolHCID 69222745HCID 69222745, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 69221288HCID 69221288, compound

Sources & evidence

ORD record
ord-47bfa2996e6948ac96bcf9d2f6059be9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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