Acetone → Perchlorate

HRID 314228Notes

Reaction equation

HRID 314228 reaction equation
[CH2:17]([O:18][CH2:19][CH3:20])[CH3:21].[CH2:22]([CH3:23])[O:24][C:25]([CH:26]([NH:27][CH3:28])[CH2:29][CH2:30][S:31][CH3:32])=[O:33].[CH3:10][S:11][c:12]1[s+:13][cH:14][cH:15][s:16]1.[CH3:1][C:2](=[O:3])[CH3:4].[CH3:34][CH2:35][O:36][C:37](=[O:38])[CH3:39].[Cl+3:5]([O-:6])([O-:7])([O-:8])[O-:9]>>[Cl+3:5]([O-:6])([O-:7])([O-:8])[O-:9].[c:12]1(=[N+:27]([CH:26]([C:25]([O:24][CH2:22][CH3:23])=[O:33])[CH2:29][CH2:30][S:31][CH3:32])[CH3:28])[s:13][cH:14][cH:15][s:16]1

Participants

8

Reactant 6

HCID 180AcetoneHCID 3283Diethyl EtherHCID 8857Ethyl AcetateHCID 123351PerchlorateHCID 120762262-Methylsulfanyl-1,3-dithiol-1-iumHCID 20144150Ethyl 2-(methylamino)-4-(methylsulfanyl)butanoate

Product 2

HCID 123351PerchlorateHCID 201441471,3-Dithiol-2-ylidene-(1-ethoxy-4-methylsulfanyl-1-oxobutan-2-yl)-methylazanium

Sources & evidence

ORD record
ord-f82fe3dd67634922bf927b08aa008eab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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