Acetic Acid → 4-Oxocyclohexyl 4-methylbenzene-1-sulfonate

HRID 2341757Notes

Reaction equation

HRID 2341757 reaction equation
[C:34]([OH:35])(=[O:36])[CH3:37].[CH3:38][CH2:39][O:40][CH2:41][CH3:42].[Cl:19][CH:20]([Cl:21])[Cl:22].[O:23]=[Cr:24]([Cl:25])([O-:26])=[O:27].[OH:1][CH:2]1[CH2:3][CH2:4][CH:5]([O:8][S:9](=[O:10])(=[O:11])[c:12]2[cH:13][cH:14][c:15]([CH3:18])[cH:16][cH:17]2)[CH2:6][CH2:7]1.[nH+:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1>>[O:1]=[C:2]1[CH2:3][CH2:4][CH:5]([O:8][S:9](=[O:10])(=[O:11])[c:12]2[cH:13][cH:14][c:15]([CH3:18])[cH:16][cH:17]2)[CH2:6][CH2:7]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 3283Diethyl EtherHCID 6212ChloroformHCID 4989215PyridiniumHCID 13138782HCID 13138782, compoundHCID 178418299HCID 178418299, compound

Product 1

HCID 2820764-Oxocyclohexyl 4-methylbenzene-1-sulfonate

Sources & evidence

ORD record
ord-a7304b81e064481e85e5ecf7409cc085
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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