5,6-Bis(nitrooxy)hexyl 4-nitrobenzoate → 4,5-Bis(nitrooxy)pentyl alcohol

HRID 282280Notes

Reaction equation

HRID 282280 reaction equation
[N+:1]([c:2]1[cH:3][cH:4][c:5]([C:6]([O:7][CH2:8][CH2:9][CH2:10][CH2:11][CH:12]([O:13][N+:14]([O-:15])=[O:16])[CH2:17][O:18][N+:19]([O-:20])=[O:21])=[O:22])[cH:23][cH:24]1)([O-:25])=[O:26].[N+:27]([c:28]1[cH:29][cH:30][c:31]([C:32](=[O:33])[O:36][CH2:37][CH2:38][CH2:39][CH:40]([CH2:41][O:42][N+:43](=[O:44])[O-:45])[O:46][N+:47](=[O:48])[O-:49])[cH:34][cH:35]1)([O-:50])=[O:51]>>[OH:36][CH2:37][CH2:38][CH2:39][CH:40]([CH2:41][O:42][N+:43](=[O:44])[O-:45])[O:46][N+:47](=[O:48])[O-:49]

Participants

3

Reactant 2

HCID 765458355,6-Bis(nitrooxy)hexyl 4-nitrobenzoateHCID 872168974,5-Dinitrooxypentyl 4-nitrobenzoate

Product 1

HCID 579416234,5-Bis(nitrooxy)pentyl alcohol

Sources & evidence

ORD record
ord-730bc5d74a474e8b9596b8553ff1c50e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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