3,5-Dimethyl-4-(2-iodoethyl)isoxazole

Base Information

• Chemical Name: 3,5-Dimethyl-4-(2-iodoethyl)isoxazole
• CAS No.: 83467-36-1
• Molecular Formula: C₇H₁₀INO
• Molecular Weight: 251.067
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID00404620
• Wikidata: Q72470712
• Mol file: 83467-36-1.mol

Synonyms:83467-36-1;3,5-Dimethyl-4-(2-iodoethyl)isoxazole;4-(2-Iodoethyl)-3,5-dimethylisoxazole;4-(2-iodoethyl)-3,5-dimethyl-1,2-oxazole;3,5-Dimethyl-4-(2-iodoethyl)-isoxazole;DTXSID00404620;FT-0614667;A915597;2,3,4,6-Tetra-O-acetyl-alpha-D-galactopyranosylbromide

Chemical Property of 3,5-Dimethyl-4-(2-iodoethyl)isoxazole

Chemical Property:

• Vapor Pressure: 0.00432mmHg at 25°C
• Refractive Index: 1.565
• Boiling Point: 287.3 °C at 760 mmHg
• Flash Point: 127.6 °C
• PSA: 26.03000
• Density: 1.677 g/cm³
• LogP: 2.26890
• Storage Temp.: 2-8°C
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 250.98071
• Heavy Atom Count: 10
• Complexity: 110

Purity/Quality:

98%min ^*data from raw suppliers

4-(2-Iodoethyl)-3,5-dimethylisoxazole 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=NO1)C)CCI

Technology Process of 3,5-Dimethyl-4-(2-iodoethyl)isoxazole

There total 1 articles about 3,5-Dimethyl-4-(2-iodoethyl)isoxazole 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: 55.0%

1,1-diacetylcyclopropane (695-70-5) → 3,5-dimethyl-4-(2-iodoethyl)isoxazole (83467-36-1)

Guidance literature:

With ammonium iodide; hydroxyammonium sulfate; sulfuric acid; In water; for 12h; Ambient temperature;

DOI:10.1016/0040-4020(82)80149-X

upstream raw materials:

1,1-diacetylcyclopropane

Refernces