2-Nonyl-1,3-dioxolane

Base Information

• Chemical Name: 2-Nonyl-1,3-dioxolane
• CAS No.: 4353-06-4
• Molecular Formula: C12H24O2
• Molecular Weight: 200.321
• Hs Code.: 2932999099
• European Community (EC) Number: 224-422-1
• NSC Number: 6620
• UNII: Z1S2N84X7X
• DSSTox Substance ID: DTXSID7063427
• Nikkaji Number: J205.730A
• Wikidata: Q27294880
• Mol file: 4353-06-4.mol

Synonyms:2-n-nonyl-1,3-dioxolane;2-SEPA;SEPA 0009

Chemical Property of 2-Nonyl-1,3-dioxolane

Chemical Property:

• Vapor Pressure: 0.0397mmHg at 25°C
• Refractive Index: 1.438
• Boiling Point: 247.7 °C at 760 mmHg
• Flash Point: 95.9 °C
• PSA: 18.46000
• Density: 0.894 g/cm³
• LogP: 3.50000
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 8
• Exact Mass: 200.177630004
• Heavy Atom Count: 14
• Complexity: 120

Purity/Quality:

99%, ^*data from raw suppliers

2-N-NONYL-1,3-DIOXOLANE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCC1OCCO1

Technology Process of 2-Nonyl-1,3-dioxolane

There total 12 articles about 2-Nonyl-1,3-dioxolane 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: 98.0%

caprinaldehyde (112-31-2) + ethylene glycol (107-21-1) → 2-n-nonyl-1,3-dioxolane (4353-06-4)

Guidance literature:

indium(III) chloride; In cyclohexane; for 10h; Heating;

DOI:10.1002/adsc.200303154

Reference yield: 94.0%

caprinaldehyde (112-31-2) + 2,2,7,7-tetramethyl-3,6-dioxa-2,7-disilaoctane (7381-30-8) → 2-n-nonyl-1,3-dioxolane (4353-06-4)

Guidance literature:

With bismuth(lll) trifluoromethanesulfonate; for 14h;

DOI:10.1055/s-0030-1258148

Reference yield:

2-phenyl-1,3-dioxolane (936-51-6) + 1,1-dimethoxy decane (7779-41-1) → 2-n-nonyl-1,3-dioxolane (4353-06-4) + C9H10O3 (94-33-7)

Guidance literature:

With palladium 10% on activated carbon; oxygen; In ethylene glycol; at 80 ℃; for 6h; chemoselective reaction;

DOI:10.1021/acs.orglett.6b02833

upstream raw materials:

2-non-8-ynyl-[1,3]dioxolane

2-(5-[2]thienylmethyl-[2]thienyl)-[1,3]dioxolane

caprinaldehyde

ethylene glycol

Downstream raw materials:

Methyl decanoate

decanoic acid ethyl ester

isopropyl decanoate

2-hydroxyethyl decanoate

Refernces

• 1、 Yasukawa, Naoki,Asai, Shota,Kato, Maho,Monguchi, Yasunari,Sajiki, Hironao,Sawama, Yoshinari. "Palladium on Carbon-Catalyzed Chemoselective Oxygen Oxidation of Aromatic Acetals". supporting information. p. 5604 - 5607. Retrieved 2016/11/17.
• 2、 Podgorski, Daniel M.,Krabbe, Scott W.,Le, Long N.,Sierszulski, Paul R.,Mohan, Ram S.. "Bismuth compounds in organic synthesis: Synthesis of dioxanes, dioxepines, and dioxolanes catalyzed by bismuth(III) triflate". experimental part. p. 2771 - 2775. Retrieved 2010/10/02.