Acetone → HCID 90813934, compound

HRID 2320147Notes

Reaction equation

HRID 2320147 reaction equation
[CH3:16][CH2:17][N:18]([CH2:19][CH3:20])[CH2:21][CH3:22].[CH3:35][C:36](=[O:37])[CH3:38].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:7][c:8]([CH:10]=[CH:11][C:12](=[O:13])[OH:14])[s:9]2)[cH:15]1.[Cl:23][C:24]([O:25][CH2:26][CH:27]([CH3:28])[CH3:29])=[O:30].[N-:31]=[N+:32]=[N-:33].[Na+:34].[OH2:39]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:7][c:8]([CH:10]=[CH:11][C:12](=[O:13])[N:31]=[N+:32]=[N-:33])[s:9]2)[cH:15]1

Participants

8

Reactant 7

HCID 180AcetoneHCID 923Sodium ionHCID 962WaterHCID 8471TriethylamineHCID 33558AzideHCID 62365Isobutyl chloroformateHCID 68712410HCID 68712410, compound

Product 1

HCID 90813934HCID 90813934, compound

Sources & evidence

ORD record
ord-885ad625df814179a679de5ef86379ff
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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