Hydrochloric Acid → SR 11217

Reaction equation

[CH3:1][C:2]1([CH3:28])[c:3]2[cH:4][cH:5][c:6]([C:14](=[C:15]([CH3:16])[CH3:17])[c:18]3[cH:19][cH:20][c:21]([C:22](=[O:23])[O:24][CH3:25])[cH:26][cH:27]3)[cH:7][c:8]2[C:9]([CH3:12])([CH3:13])[CH2:10][CH2:11]1.[CH3:32][OH:33].[ClH:31].[K+:30].[OH-:29]>>[CH3:1][C:2]1([CH3:28])[c:3]2[cH:4][cH:5][c:6]([C:14](=[C:15]([CH3:16])[CH3:17])[c:18]3[cH:19][cH:20][c:21]([C:22](=[O:23])[OH:24])[cH:26][cH:27]3)[cH:7][c:8]2[C:9]([CH3:12])([CH3:13])[CH2:10][CH2:11]1

Participants

Reactant 5

HCID 313Hydrochloric Acid

HCID 813Potassium Cation

HCID 887Methanol

HCID 961Hydroxide

HCID 10362193Methyl 4-[1-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-2-methyl-1-propenyl]benzoate

Product 1

HCID 3035780SR 11217

Sources & evidence

ORD record: ord-b7888b028da8443497a8f2b189664817
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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