2-Butyl-4-methyl-1,3-dioxolane

Base Information

• Chemical Name: 2-Butyl-4-methyl-1,3-dioxolane
• CAS No.: 74094-60-3
• Molecular Formula: C8H16O2
• Molecular Weight: 144.214
• European Community (EC) Number: 277-710-4
• DSSTox Substance ID: DTXSID20868280
• Nikkaji Number: J285.543G
• Metabolomics Workbench ID: 45598
• Mol file: 74094-60-3.mol

Synonyms:2-Butyl-4-methyl-1,3-dioxolane;74094-60-3;Valeraldehyde propyleneglycol acetal;1,3-Dioxolane, 2-butyl-4-methyl-;Pentanal propyleneglycol acetal;UNII-N5U0ZL00CI;1,3-Dioxolane, 4-methyl-2-butyl;EINECS 277-710-4;N5U0ZL00CI;SCHEMBL3504388;DTXSID20868280;CHEBI:179950;4-Methyl-2-butyl-1,3-dioxolane;valeraldehyde propylene glycol acetal;2-Butyl-4-methyl-1,3-dioxolane #;1,3-Dioxolane, 2-butyl-4-methyl, cis;AS-60051;1,3-Dioxolane, 2-butyl-4-methyl, trans;D93006

Chemical Property of 2-Butyl-4-methyl-1,3-dioxolane

Chemical Property:

• Vapor Pressure: 2.32mmHg at 25°C
• Refractive Index: 1.414
• Boiling Point: 166.7 °C at 760 mmHg
• Flash Point: 53 °C
• PSA: 18.46000
• Density: 0.893 g/cm³
• LogP: 1.93800
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 144.115029749
• Heavy Atom Count: 10
• Complexity: 93.3

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC1OCC(O1)C

Technology Process of 2-Butyl-4-methyl-1,3-dioxolane

There total 1 articles about 2-Butyl-4-methyl-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:

propylene glycol (57-55-6,63625-56-9) + pentanal (110-62-3) → pentanal propylene glycol acetal (74094-60-3)

Guidance literature:

toluene-4-sulfonic acid; In benzene; Heating;

DOI:10.1021/j150648a038

upstream raw materials:

propylene glycol

pentanal

Refernces

• 1、 Romero, Jordi,Ventura, Francesc,Caixach, Josep,Rivera, Josep,Gode, Llui Xavier,Ninerola, Josep Ma.. "Identification of 1,3-dioxanes and 1,3-dioxolanes as malodorous compounds at trace levels in river water, groundwater, and tap water". . p. 206 - 216. Retrieved 2007/10/03.
• 2、 Sokolowski, Adam,Burczyk, Bogdan,Oles, Jan. "Acetals and Ethers. 11. Solubility of Alkyl-Substituted 1,3-Dioxolanes and 1,3-Dioxanes in Water". . p. 807 - 809. Retrieved 2007/10/02.