Metoxadiazone

Base Information

• Chemical Name: Metoxadiazone
• CAS No.: 60589-06-2
• Molecular Formula: C10H10 N2 O4
• Molecular Weight: 222.2
• UNII: 15Z0OMV86O
• DSSTox Substance ID: DTXSID50866815
• Nikkaji Number: J65.683F
• Wikidata: Q27155119
• Mol file: 60589-06-2.mol

Synonyms:3-(2-methoxyphenyl)-5-methoxy-1,3,4-oxadiazol-2(3H)-one;MPOX

Chemical Property of Metoxadiazone

Chemical Property:

• Vapor Pressure: 0.00238mmHg at 25°C
• Refractive Index: 1.574
• Boiling Point: 288.2°C at 760 mmHg
• PKA: -0.95±0.40(Predicted)
• Flash Point: 128.1°C
• PSA: 66.49000
• Density: 1.32g/cm³
• LogP: 0.84270
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 222.06405680
• Heavy Atom Count: 16
• Complexity: 305

Purity/Quality:

99% ^*data from raw suppliers

Metoxadiazone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=CC=C1N2C(=O)OC(=N2)OC

Technology Process of Metoxadiazone

There total 3 articles about Metoxadiazone 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: 46.0%

1-methoxycarbonyl-2-phenoxycarbonyl-2-(2-methoxyphenyl) hydrazine (1221437-74-6) → 3-(2-methoxyphenyl)-5-methoxy-1,3,4-oxadiazol-2(3H)-one (60589-06-2)

Guidance literature:

With sodium hydride; In acetonitrile; paraffin; at 0 ℃; for 1h; Product distribution / selectivity; Inert atmosphere;

Reference yield:

methyl 2-(2-methoxyphenyl)hydrazine-1-carboxylate (60589-24-4) → 3-(2-methoxyphenyl)-5-methoxy-1,3,4-oxadiazol-2(3H)-one (60589-06-2)

Guidance literature:

Multi-step reaction with 2 steps

1: triethylamine / tetrahydrofuran / 3 h / 20 °C / Inert atmosphere

2: sodium hydride / acetonitrile; paraffin / 1 h / 0 °C / Inert atmosphere

With sodium hydride; triethylamine; In tetrahydrofuran; acetonitrile; paraffin;

Reference yield:

→ 3-(2-methoxyphenyl)-5-methoxy-1,3,4-oxadiazol-2(3H)-one (60589-06-2)

Guidance literature:

entspr.Carbazat, COCl2;

upstream raw materials:

1-methoxycarbonyl-2-phenoxycarbonyl-2-(2-methoxyphenyl) hydrazine

methyl 2-(2-methoxyphenyl)hydrazine-1-carboxylate

Refernces

• 1、 -. "Derivatives of alkoxy-5-phenyl-3 oxadiazoline-1,3,4 one-2, their preparation and insecticidal and acaricidal compositions which contain them". . . Retrieved 2008/06/13.