Formaldehyde → Dihexyl oxalate

HRID 123836

Reaction equation

HRID 123836 reaction equation
[C:15]([CH2:16][C:17](=[O:18])[O:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH3:25])([O:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH3:32])=[O:33].[C:1]=[O:2].[CH2:3]=[C:4]=[O:5].[N:6](=[O:7])[O:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH3:14]>>[O:5]=[C:16]([O:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH3:14])[C:17](=[O:18])[O:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH3:25]

Participants

5

Reactant 4

HCID 712FormaldehydeHCID 10038KeteneHCID 6365123Nitrous acid, hexyl esterHCID 9835215Dihexyl Malonate

Product 1

HCID 524363Dihexyl oxalate

Sources & evidence

ORD record
ord-3ecca6075fd947039cd486e0544fa13c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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