Acetate → HCID 136393657, compound

HRID 182068Notes

Reaction equation

HRID 182068 reaction equation
[CH2:24]([CH3:25])[O:26][NH2:27].[CH3:29][C:30](=[O:31])[O-:32].[CH3:34][CH2:35][OH:36].[ClH:23].[ClH:33].[Na+:28].[OH:1][C:2]1=[C:3]([C:18]([CH2:19][CH2:20][CH3:21])=[O:22])[C:4](=[O:17])[CH2:5][CH:6]([c:8]2[cH:9][c:10]3[c:11]([o:12]2)[cH:13][cH:14][cH:15][cH:16]3)[CH2:7]1>>[OH:1][C:2]1=[C:3]([C:18]([CH2:19][CH2:20][CH3:21])=[N:27][O:26][CH2:24][CH3:25])[C:4](=[O:17])[CH2:5][CH:6]([c:8]2[cH:9][c:10]3[c:11]([o:12]2)[cH:13][cH:14][cH:15][cH:16]3)[CH2:7]1

Participants

7

Reactant 6

HCID 175AcetateHCID 313Hydrochloric Acid2×HCID 702EthanolHCID 923Sodium ionHCID 69357Hydroxylamine, O-ethyl-HCID 178450306HCID 178450306, compound

Product 1

HCID 136393657HCID 136393657, compound

Sources & evidence

ORD record
ord-305888f7c52f45ecbe2bc6cf32e29311
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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