Nitromethane → 5-Nonanone

HRID 1230266Notes

Reaction equation

HRID 1230266 reaction equation
[CH3:13][CH2:14][CH2:15][CH2:16][CH:17]([CH2:18][CH2:19][CH2:20][CH3:21])[OH:22].[I:1][c:2]1[cH:3][cH:4][c:5]([CH3:6])[cH:7][c:8]1[S:9]([OH:10])(=[O:11])=[O:12].[N+:23]([CH3:24])([O-:25])=[O:26]>>[CH3:13][CH2:14][CH2:15][CH2:16][C:17]([CH2:18][CH2:19][CH2:20][CH3:21])=[O:22]

Participants

4

Reactant 3

HCID 6375NitromethaneHCID 12202Nonan-5-olHCID 134448562-Iodo-5-methylbenzene-1-sulfonic acid

Product 1

HCID 104055-Nonanone

Sources & evidence

ORD record
ord-2db398f37e00498ba58dcdfb7cfb06ff
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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