Methanol → Octanoic acid, 3,7-dimethyl-

HRID 201953

Reaction equation

[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH:6]([CH2:7][CH2:8][CH2:9][CH:10]([CH3:11])[CH3:12])[CH3:13])=[O:14].[CH3:15][OH:16].[Na+:18].[OH-:17]>>[O:3]=[C:4]([CH2:5][CH:6]([CH2:7][CH2:8][CH2:9][CH:10]([CH3:11])[CH3:12])[CH3:13])[OH:14]

Participants

Reactant 4

HCID 887Methanol

HCID 923Sodium ion

HCID 961Hydroxide

HCID 349987Ethyl 3,7-dimethyloctanoate

Product 1

HCID 98008Octanoic acid, 3,7-dimethyl-

Sources & evidence

ORD record: ord-128ab9c7d87d47168e3076c346017904
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

Linked notes

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