Chloride → 2-(1,1,4,4,7-Pentamethyl-2,3-dihydronaphthalen-2-yl)acetic acid

HRID 171899Notes

Reaction equation

[Al+3:21].[CH3:1][C:2]1([CH3:19])[CH:3]([CH2:8][C:9]([CH3:10])([c:11]2[cH:12][cH:13][c:14]([CH3:17])[cH:15][cH:16]2)[CH3:18])[CH2:4][C:5](=[O:7])[O:6]1.[CH3:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1.[Cl-:20].[Cl-:22].[Cl-:23]>>[CH3:1][C:2]1([CH3:19])[CH:3]([CH2:4][C:5]([OH:6])=[O:7])[CH2:8][C:9]([CH3:10])([CH3:18])[c:11]2[cH:12][cH:13][c:14]([CH3:17])[cH:15][c:16]21

Participants

Reactant 4

HCID 312Chloride3×

HCID 1140Toluene

HCID 104727Aluminum Cation

HCID 212949665,5-Dimethyl-4-[2-methyl-2-(4-methylphenyl)propyl]oxolan-2-one

Product 1

HCID 131750252-(1,1,4,4,7-Pentamethyl-2,3-dihydronaphthalen-2-yl)acetic acid

Sources & evidence

ORD record: ord-027c5657a408420ebc5dc2c3bd24f380
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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