1,3-Dioxolan-2-one, 4-octyl-

Base Information

• Chemical Name: 1,3-Dioxolan-2-one, 4-octyl-
• CAS No.: 99260-48-7
• Molecular Formula: C11H20O3
• Molecular Weight: 200.278
• DSSTox Substance ID: DTXSID80467233
• Nikkaji Number: J1.461.792B
• Mol file: 99260-48-7.mol

Synonyms:1,3-Dioxolan-2-one, 4-octyl-;99260-48-7;1,2-decylene carbonate;SCHEMBL9576975;DTXSID80467233

Chemical Property of 1,3-Dioxolan-2-one, 4-octyl-

Chemical Property:

• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 200.14124450
• Heavy Atom Count: 14
• Complexity: 168

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC1COC(=O)O1

Technology Process of 1,3-Dioxolan-2-one, 4-octyl-

There total 2 articles about 1,3-Dioxolan-2-one, 4-octyl- 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:

1,2-Epoxydecane (2404-44-6) + carbon dioxide (124-38-9,18923-20-1) → 1,2-decanediol (1119-86-4) + 4-octyl-1,3-dioxolan-2-one (99260-48-7)

Guidance literature:

With tetrabutylammomium bromide; water; at 100 ℃; for 9h; under 750.075 Torr; Schlenk technique;

DOI:10.1039/c9cy01329f

Reference yield:

1-Decene (872-05-9,17438-89-0,25189-70-2) + carbon dioxide (124-38-9,18923-20-1) → 1,2-Epoxydecane (2404-44-6) + 4-octyl-1,3-dioxolan-2-one (99260-48-7)

Guidance literature:

With n-trioctyl methyl ammonium tungstate; phosphoric acid; dihydrogen peroxide; at 85 ℃; for 18h; under 37503.8 Torr; Autoclave;

DOI:10.1039/d1gc02603h

Reference yield:

acetic anhydride (108-24-7) + 4-octyl-1,3-dioxolan-2-one (99260-48-7) → decane-2-yl acetate (1534-32-3) + n-decyl acetate (112-17-4) + acetic acid 2-acetoxy-decyl ester (60671-14-9)

Guidance literature:

With pyridine; 18-crown-6 ether; tert-butylamine; Yield given. Multistep reaction. Yields of byproduct given; 1.) ether, room temperature;

upstream raw materials:

1,2-Epoxydecane

carbon dioxide

1-Decene

Downstream raw materials:

decane-2-yl acetate

n-decyl acetate

acetic acid 2-acetoxy-decyl ester

(S)-decane-1,2-diol