Benzene → Neophyl acetate

HRID 138800Notes

Reaction equation

HRID 138800 reaction equation
[Al+3:10].[C:1]([CH3:2])(=[O:3])[O:4][CH2:5][C:6]([CH3:7])=[CH2:8].[Cl-:11].[Cl-:12].[Cl-:9].[cH:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1>>[C:1]([CH3:2])(=[O:3])[O:4][CH2:5][C:6]([CH3:7])([CH3:8])[c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1

Participants

5

Reactant 4

HCID 241BenzeneHCID 312Chloride3×HCID 699622-Methylallyl acetateHCID 104727Aluminum Cation

Product 1

HCID 303084Neophyl acetate

Sources & evidence

ORD record
ord-688adc34700b4a3a83d64ebb4f08bfce
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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