2-Methyl-2-pentyl-1,3-dioxolane

Base Information

• Chemical Name: 2-Methyl-2-pentyl-1,3-dioxolane
• CAS No.: 4352-95-8
• Molecular Formula: C9H18O2
• Molecular Weight: 158.241
• DSSTox Substance ID: DTXSID80195867
• Nikkaji Number: J42.156A
• Wikidata: Q83068922
• Mol file: 4352-95-8.mol

Synonyms:2-Methyl-2-pentyl-1,3-dioxolane;4352-95-8;1,3-DIOXOLANE, 2-METHYL-2-PENTYL-;BRN 0105174;5-19-01-00145 (Beilstein Handbook Reference);methyl-pentyl-dioxolane;2-Heptanone ethylene acetal;SCHEMBL13361696;DTXSID80195867;2-Methyl-2-pentyl-1,3-dioxolane #;LS-62644;2-Heptanone, cyclic 1,2-ethanediyl acetal

Chemical Property of 2-Methyl-2-pentyl-1,3-dioxolane

Chemical Property:

• Vapor Pressure: 1.46mmHg at 25°C
• Boiling Point: 176.6°Cat760mmHg
• Flash Point: 58.5°C
• PSA: 18.46000
• Density: 0.897g/cm³
• LogP: 2.32970
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 158.130679813
• Heavy Atom Count: 11
• Complexity: 106

Purity/Quality:

2-METHYL-2-PENTYL-1,3-DIOXOLANE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC1(OCCO1)C

Technology Process of 2-Methyl-2-pentyl-1,3-dioxolane

There total 3 articles about 2-Methyl-2-pentyl-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: 80.0%

n-pentyl methyl ketone (110-43-0) + ethylene glycol (107-21-1) → 2-Heptanone 1,2-ethanediyl acetal (4352-95-8)

Guidance literature:

With iodine; for 16h;

DOI:10.1016/j.tetlet.2005.01.176

Reference yield:

1-Heptyne (628-71-7) + ethylene glycol (107-21-1) → 2-Heptanone 1,2-ethanediyl acetal (4352-95-8)

Guidance literature:

With methanol; boron fluoride ether; mercury(II) oxide;

Reference yield:

→ 2-Heptanone 1,2-ethanediyl acetal (4352-95-8)

Guidance literature:

2-(4-Chlor-butyl)-2-methyl-<1,3>-dioxolan 1) Mg in Tetrahydrofuran, Dimethylsulfat 2) wss. Alkali;

upstream raw materials:

1-Heptyne

ethylene glycol

n-pentyl methyl ketone

Downstream raw materials:

n-pentyl methyl ketone

2-hydroxyethyl acetate

5-n-Pentyl-1,2,4-benzenetricarbonitrile

2-n-Pentyl-1,4-butanedioic acid dimethyl ester

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