2-(3-METHYL-3-NITROBUTYL)-1,3-DIOXOLANE

Base Information

• Chemical Name: 2-(3-METHYL-3-NITROBUTYL)-1,3-DIOXOLANE
• CAS No.: 57620-56-1
• Molecular Formula: C8H15NO4
• Molecular Weight: 189.211
• Mol file: 57620-56-1.mol

Synonyms:2-(3-METHYL-3-NITROBUTYL)-1,3-DIOXOLANE

Chemical Property of 2-(3-METHYL-3-NITROBUTYL)-1,3-DIOXOLANE

Chemical Property:

• Vapor Pressure: 0.00434mmHg at 25°C
• Refractive Index: n20/D 1.454(lit.)
• Boiling Point: 98-99 °C1 mm Hg(lit.)
• Flash Point: >230 °F
• PSA: 64.28000
• Density: 1.13 g/mL at 25 °C(lit.)
• LogP: 1.71800

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-(3-Methyl-3-nitrobutyl)-1,3-dioxolane 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Uses: 2-(3-Methyl-3-nitrobutyl)-1,3-dioxolane may be used in the preparation of spin trap reagent, dimethyl-Δ′-pyrroline-1-oxide (DMPO).

Technology Process of 2-(3-METHYL-3-NITROBUTYL)-1,3-DIOXOLANE

There total 3 articles about 2-(3-METHYL-3-NITROBUTYL)-1,3-DIOXOLANE which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

4-methyl-4-nitropentanal (57620-49-2) + ethylene glycol (107-21-1) → 2-(3-methyl-3-nitrobutyl)-[1,3]dioxolane (57620-56-1)

Guidance literature:

With toluene-4-sulfonic acid; benzene; Unter Entfernen des entstehenden Wassers_.;

Reference yield:

2-nitropropane (79-46-9) + ethylene glycol (107-21-1) + acrolein (107-02-8,25068-14-8) → 2-(3-methyl-3-nitrobutyl)-[1,3]dioxolane (57620-56-1)

Guidance literature:

With toluene-4-sulfonic acid; Multistep reaction; 2.) C₆H₆, reflux;

Reference yield:

→ 2-(3-methyl-3-nitrobutyl)-[1,3]dioxolane (57620-56-1)

Guidance literature:

DOI:10.1021/jo00867a023

upstream raw materials:

4-methyl-4-nitropentanal

ethylene glycol

2-nitropropane

acrolein

Downstream raw materials:

5,5-Dimethyl-1-pyrroline N-oxide

α-(2,4-difluorophenyl)-N-[dimethyl(3,3-ethylenedioxy-1-propyl)methyl]nitrone

Refernces

• 1、 Gibson, Neil J.,Forrester, Alexander R.. "Acylation of Aldo 1-Pyrroline 1-Oxides (4,5-Dihydro-3H-pyrrole 1-Oxides) and the Oxidation of the Resulting 3-Acyloxy-1-pyrrolines (3-Acyloxy-4,5-dihydro-3H-pyrroles)". . p. 491 - 500. Retrieved 2007/10/02.