Acetic Acid → HCID 20478446, compound

HRID 301625Notes

Reaction equation

HRID 301625 reaction equation
[CH3:23][C:24](=[O:25])[OH:26].[CH3:27][CH2:28][O:29][C:30](=[O:31])[CH3:32].[NH2:1][c:2]1[c:3]([CH2:20][CH2:21][CH3:22])[c:4]2[c:5]([c:6](=[O:14])[cH:7][c:8]([C:10](=[O:11])[O:12][CH3:13])[o:9]2)[cH:15][c:16]1[N+:17]([O-:18])=[O:19]>>[NH2:1][c:2]1[c:3]([CH2:20][CH2:21][CH3:22])[c:4]2[c:5]([c:6](=[O:14])[cH:7][c:8]([C:10](=[O:11])[O:12][CH3:13])[o:9]2)[cH:15][c:16]1[NH2:17]

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 8857Ethyl AcetateHCID 20478439HCID 20478439, compound

Product 1

HCID 20478446HCID 20478446, compound

Sources & evidence

ORD record
ord-adb35d9a9e214bda83e0004a1d861b72
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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