Benzene → 1-Methylethyl 2-butenoate

HRID 682015

Reaction equation

HRID 682015 reaction equation
[C:1]([CH:2]=[CH:3][CH3:4])(=[O:5])[OH:6].[CH:7]([CH3:8])([CH3:9])[OH:10].[S:11](=[O:12])(=[O:13])([OH:14])[OH:15].[c:16]1([CH3:17])[cH:18][cH:19][c:20]([S:21]([OH:22])(=[O:23])=[O:24])[cH:25][cH:26]1.[cH:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1>>[C:1]([CH:2]=[CH:3][CH3:4])([O:5][CH:7]([CH3:8])[CH3:9])=[O:6]

Participants

6

Reactant 5

HCID 241BenzeneHCID 1118Sulfuric AcidHCID 3776IsopropanolHCID 6101p-Toluenesulfonic acidHCID 194992-Butenoic acid

Product 1

HCID 866511-Methylethyl 2-butenoate

Sources & evidence

ORD record
ord-4978c637b96f43c6b3fa51eda211b5c5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

Loading…