Acetone → HCID 19775543, compound

HRID 668063Notes

Reaction equation

HRID 668063 reaction equation
[CH2:17]=[CH:18][C:19]([CH2:20][CH2:21][CH3:22])=[O:23].[CH3:26][C:27](=[O:28])[CH3:29].[ClH:24].[N:11]([O-:12])=[O:13].[NH2:1][c:2]1[cH:3][cH:4][c:5]([N+:8]([O-:9])=[O:10])[cH:6][cH:7]1.[Na+:14].[Na+:16].[OH-:15].[OH2:25]>>[c:2]1([CH2:17][CH:18]([C:19]([CH2:20][CH2:21][CH3:22])=[O:23])[Cl:24])[cH:3][cH:4][c:5]([N+:8]([O-:9])=[O:10])[cH:6][cH:7]1

Participants

9

Reactant 8

HCID 180AcetoneHCID 313Hydrochloric AcidHCID 923Sodium ion2×HCID 946NitriteHCID 961HydroxideHCID 962WaterHCID 74754-NitroanilineHCID 153951-Hexen-3-one

Product 1

HCID 19775543HCID 19775543, compound

Sources & evidence

ORD record
ord-f175dfd847154c67a5f217bd83d8fc30
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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