3-Isoxazolidinone, 2-methyl-

Base Information

• Chemical Name: 3-Isoxazolidinone, 2-methyl-
• CAS No.: 40784-12-1
• Molecular Formula: C₄H₇NO₂
• Molecular Weight: 101.105
• DSSTox Substance ID: DTXSID10193770
• Nikkaji Number: J96.748C
• Wikidata: Q83066496
• Mol file: 40784-12-1.mol

Synonyms:2-Methylisoxazolidin-3-one;40784-12-1;3-Isoxazolidinone, 2-methyl-;BRN 0636129;2-Methylisoxazolid-3(2H)-one;3-ISOXAZOLIDINONE, 2-METHYL;SCHEMBL1708922;DTXSID10193770;LS-86769

Chemical Property of 3-Isoxazolidinone, 2-methyl-

Chemical Property:

• Vapor Pressure: 21.3mmHg at 25°C
• Boiling Point: 113°C at 760 mmHg
• Flash Point: 22.1°C
• Density: 1.157g/cm³
• XLogP3: -0.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 101.047678466
• Heavy Atom Count: 7
• Complexity: 91.7

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C(=O)CCO1

Technology Process of 3-Isoxazolidinone, 2-methyl-

There total 5 articles about 3-Isoxazolidinone, 2-methyl- 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:

2-methyl-isoxazolidin-3-ylideneamine; hydriodide → 2-Methyl-3-isoxazolidin (40784-12-1)

Guidance literature:

With sodium hydroxide; at 0 - 10 ℃;

Reference yield:

diazomethane (186581-53-3,908094-01-9,334-88-3) + isoxazolidin-3-one (1192-07-0) → 2-Methyl-3-isoxazolidin (40784-12-1)

Guidance literature:

In methanol; ethanol; for 12h; Ambient temperature;

DOI:10.1007/BF00476136

Reference yield:

methyl bromide (74-83-9) + isoxazolidin-3-one, K-salt (40784-11-0) → 2-Methyl-3-isoxazolidin (40784-12-1)

Guidance literature:

In ethanol; for 72h; Ambient temperature;

DOI:10.1007/BF00476136

upstream raw materials:

diazomethane

isoxazolidin-3-one

methyl bromide

isoxazolidin-3-one, K-salt