1-Oxacyclononadecan-2-one

Base Information

• Chemical Name: 1-Oxacyclononadecan-2-one
• CAS No.: 4444-85-3
• Molecular Formula: C18H34O2
• Molecular Weight: 282.467
• DSSTox Substance ID: DTXSID00504917
• Metabolomics Workbench ID: 4390
• Nikkaji Number: J2.718.017E
• Wikidata: Q82359699

Synonyms:oxacyclononadecan-2-one;1-oxacyclononadecan-2-one;18-Octadecanolide;4444-85-3;Stearolacton;SCHEMBL3095608;DTXSID00504917;CHEBI:191925;LMFA07040056

Chemical Property of 1-Oxacyclononadecan-2-one

Chemical Property:

• XLogP3: 7.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 282.255880323
• Heavy Atom Count: 20
• Complexity: 226

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCCCCCCCC(=O)OCCCCCCCC1

Technology Process of 1-Oxacyclononadecan-2-one

There total 1 articles about 1-Oxacyclononadecan-2-one 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: 33.0%

18-hydroxystearic acid (3155-42-8) → oxacyclononadecan-2-one (4444-85-3)

Guidance literature:

With 1,3,5-trichloro-2,4,6-triazine; triethylamine; In acetone; for 6h; Ambient temperature;

DOI:10.1016/S0040-4039(00)92809-0

Reference yield: 55.0%

oxacyclononadecan-2-one (4444-85-3) → γ-palmitolactone (730-46-1)

Guidance literature:

With W(OTf)₆; at 180 ℃; for 24h; Time; Schlenk technique; Ionic liquid; Inert atmosphere; Green chemistry;

DOI:10.1002/cssc.201800587

upstream raw materials:

18-hydroxystearic acid

Downstream raw materials:

γ-palmitolactone

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