Acetate → Octanoic acid, 1-naphthalenyl ester

HRID 103033Notes

Reaction equation

[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][C:8]([OH:9])=[O:10].[CH3:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH3:41].[K+:25].[O-:21][C:22]([CH3:23])=[O:24].[O-:27][C:28]([CH3:29])=[O:30].[O-:31][C:32]([CH3:33])=[O:34].[Pd+2:26].[cH:11]1[cH:12][cH:13][c:14]2[cH:15][cH:16][cH:17][cH:18][c:19]2[cH:20]1>>[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][C:8]([O:9][c:18]1[cH:17][cH:16][cH:15][c:14]2[cH:13][cH:12][cH:11][cH:20][c:19]21)=[O:10]

Participants

Reactant 6

HCID 175Acetate3×

HCID 379Octanoic Acid

HCID 813Potassium Cation

HCID 931Naphthalene

HCID 8900Heptane

HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)

Product 1

HCID 107555Octanoic acid, 1-naphthalenyl ester

Sources & evidence

ORD record: ord-b947adc6c02b4131b3e17e4186f77e8e
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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