Methanol → Nitrate

HRID 2315973Notes

Reaction equation

HRID 2315973 reaction equation
[CH2:5]1[CH2:6][CH2:7][CH:8]([CH:11]([CH2:12][CH:13]2[CH2:14][CH2:15][CH2:16][CH2:17][NH:18]2)[CH:19]2[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24]2)[CH2:9][CH2:10]1.[CH3:25][C:26]#[N:27].[CH3:28][OH:29].[OH:1][N+:2]([O-:3])=[O:4]>>[CH2:5]1[CH2:6][CH2:7][CH:8]([CH:11]([CH2:12][CH:13]2[CH2:14][CH2:15][CH2:16][CH2:17][NH:18]2)[CH:19]2[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24]2)[CH2:9][CH2:10]1.[O:1]=[N+:2]([O-:3])[O-:4]

Participants

6

Reactant 4

HCID 887MethanolHCID 944Nitric AcidHCID 4746PerhexilineHCID 6342Acetonitrile

Product 2

HCID 943NitrateHCID 4746Perhexiline

Sources & evidence

ORD record
ord-eb922803713240a2986b7cafaa9c6540
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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