Acetone → HCID 178458161, compound

HRID 1567042Notes

Reaction equation

HRID 1567042 reaction equation
[C:50]([O:51][CH2:52][CH3:53])(=[O:54])[CH3:55].[CH3:1][C:2]1([CH3:3])[CH2:6][O:7][CH:5]([CH:8]([CH3:9])[CH:10]2[CH2:11][CH2:12][CH:13]3[CH:14]4[CH:15]([OH:31])[CH:16]=[C:17]5[CH2:18][CH:19]([OH:30])[CH:20]6[CH:21]([C:22]5([CH3:23])[CH:24]4[CH2:25][CH2:26][C:27]23[CH3:28])[O:29]6)[O:4][CH2:32]1.[CH3:44][CH2:45][CH2:46][CH2:47][CH2:48][CH3:49].[CH3:56][C:57](=[O:58])[CH3:59].[c:33]1([CH3:34])[cH:35][cH:36][c:37]([S:38]([OH:39])(=[O:40])=[O:41])[cH:42][cH:43]1>>[O:4]=[CH:5][CH:8]([CH3:9])[CH:10]1[CH2:11][CH2:12][CH:13]2[CH:14]3[CH:15]([OH:31])[CH:16]=[C:17]4[CH2:18][CH:19]([OH:30])[CH:20]5[CH:21]([C:22]4([CH3:23])[CH:24]3[CH2:25][CH2:26][C:27]12[CH3:28])[O:29]5

Participants

6

Reactant 5

HCID 180AcetoneHCID 6101p-Toluenesulfonic acidHCID 8058HexaneHCID 8857Ethyl AcetateHCID 178438137HCID 178438137, compound

Product 1

HCID 178458161HCID 178458161, compound

Sources & evidence

ORD record
ord-0b37094ec87c449c827292768100c457
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

Loading…