1,2-Dichloroethane → HCID 178475503, compound

HRID 179246Notes

Reaction equation

HRID 179246 reaction equation
[C:1]([CH3:2])(=[O:3])[O:4][C:5]1([C:6]([CH3:7])=[O:8])[CH2:9][CH2:10][CH:11]2[CH:12]3[CH2:13][CH2:14][C:15]4=[CH:16][C:17](=[O:28])[CH2:18][CH2:19][C:20]4([CH3:21])[CH:22]3[CH:23]([F:27])[CH2:24][C:25]12[CH3:26].[C:44]([OH:45])([CH3:46])([CH3:47])[CH3:48].[CH2:29]([Cl:30])[CH2:31][Cl:32].[c:33]1([CH3:34])[cH:35][cH:36][c:37]([S:38]([OH:39])(=[O:40])=[O:41])[cH:42][cH:43]1>>[C:1]([CH3:2])(=[O:3])[O:4][C:5]1([C:6]([CH3:7])=[O:8])[CH2:9][CH2:10][CH:11]2[CH:12]3[CH:13]=[CH:14][C:15]4=[CH:16][C:17](=[O:28])[CH2:18][CH2:19][C:20]4([CH3:21])[CH:22]3[CH:23]([F:27])[CH2:24][C:25]12[CH3:26]

Participants

5

Reactant 4

HCID 111,2-DichloroethaneHCID 6101p-Toluenesulfonic acidHCID 6386tert-ButanolHCID 178475504HCID 178475504, compound

Product 1

HCID 178475503HCID 178475503, compound

Sources & evidence

ORD record
ord-1ced3162d94645a28c25deecf8c32366
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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