Acetic Acid → HCID 178450394, compound

HRID 1150514Notes

Reaction equation

HRID 1150514 reaction equation
[CH3:32][CH2:33][OH:34].[CH3:35][C:36](=[O:37])[OH:38].[N:1](=[O:2])[O-:3].[Na+:4].[OH:5][CH:6]([CH2:7][N:8]([C:9]([NH:10][CH2:11][CH2:12][Cl:13])=[O:14])[CH:15]([CH:16]1[CH:17]([OH:29])[CH:18]([OH:28])[CH:19]([OH:27])[CH:20]([O:21][CH2:22][CH:23]([CH3:24])[CH3:25])[O:26]1)[OH:30])[CH3:31]>>[N:1](=[O:3])[N:10]([C:9]([N:8]([CH2:7][CH:6]([OH:5])[CH3:31])[CH:15]([CH:16]1[CH:17]([OH:29])[CH:18]([OH:28])[CH:19]([OH:27])[CH:20]([O:21][CH2:22][CH:23]([CH3:24])[CH3:25])[O:26]1)[OH:30])=[O:14])[CH2:11][CH2:12][Cl:13]

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 702EthanolHCID 923Sodium ionHCID 946NitriteHCID 178450393HCID 178450393, compound

Product 1

HCID 178450394HCID 178450394, compound

Sources & evidence

ORD record
ord-7f42450f81ff4dfeb770f40b35d6c529
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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