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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 521838Generated: October 26, 2026

2-Methyl-7-(2-methyl-4-nitro-pyrazol-3-yl)oxepan-4-one → 2-Ethyl-7-(2-methyl-4-nitro-pyrazol-3-yl)oxepan-4-one

https://huagongshe.com/reaction/521838

Reaction equation

Participants

RoleNameHCIDCharge
Reactant2-Methyl-7-(2-methyl-4-nitro-pyrazol-3-yl)oxepan-4-oneHCID 86713774—
Reactant1-Methyl-5-(5-ethyl-6,8-dioxaspiro[2.5]octan-7-yl)-4-nitro-pyrazoleHCID 86713779—
Product2-Ethyl-7-(2-methyl-4-nitro-pyrazol-3-yl)oxepan-4-oneHCID 86713780—

Reaction Steps

Following the procedure for Intermediate 5 starting from 1-methyl-5-(5-ethyl-6,8-dioxaspiro[2.5]octan-7-yl)-4-nitro-pyrazole gave 2-ethyl-7-(2-methyl-4-nitro-pyrazol-3-yl)oxepan-4-one as a colourless solid (240 mg, 13% over two steps). 1H NMR (400 MHz, CDCl3) δ 8.04 (s, 1H), 5.67 (dd, J=11.0, 2.4 Hz, 1H), 4.02 (s, 3H), 3.94 (dd, J=10.2, 5.2 Hz, 1H), 3.04 (td, J=13.3, 3.3 Hz, 1H), 2.79-2.63 (m, 3H), 2.20-2.12 (m, 1H), 2.05-1.92 (m, 1H), 1.67-1.57 (m, 2H), 0.94 (t, J=7.4 Hz, 3H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09328106B2
Source datasetuspto-grants-2016_05
ORD IDord-096aee47cd1842e29cb84fb4a85269ba
Source noteuspto-grants-2016_05