1,3-Dioxolane-2-ethanol, 2-methyl-, acetate

Base Information

• Chemical Name: 1,3-Dioxolane-2-ethanol, 2-methyl-, acetate
• CAS No.: 68039-72-5
• Molecular Formula: C8H14O4
• Molecular Weight: 174.197
• European Community (EC) Number: 268-279-3
• DSSTox Substance ID: DTXSID30887124
• Nikkaji Number: J288.972B
• Wikidata: Q82866173

Synonyms:68039-72-5;1,3-Dioxolane-2-ethanol, 2-methyl-, acetate;2-Methyl-1,3-dioxolan-2-ylethyl acetate;1,3-Dioxolane-2-ethanol, 2-methyl-, 2-acetate;2-Methyl-2-(acetoxyethyl)dioxolane;EINECS 268-279-3;DTXSID30887124;2-Methyl-1,3-dioxolane-2-ethanol acetate;2-(2-Methyl-1,3-dioxolan-2-yl)ethyl acetate #

Chemical Property of 1,3-Dioxolane-2-ethanol, 2-methyl-, acetate

Chemical Property:

• Vapor Pressure: 0.219mmHg at 25°C
• Boiling Point: 208°Cat760mmHg
• Flash Point: 80.8°C
• PSA: 44.76000
• Density: 1.066g/cm³
• LogP: 0.70260
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 174.08920892
• Heavy Atom Count: 12
• Complexity: 160

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OCCC1(OCCO1)C

Technology Process of 1,3-Dioxolane-2-ethanol, 2-methyl-, acetate

There total 3 articles about 1,3-Dioxolane-2-ethanol, 2-methyl-, acetate 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: 79.0%

2-(2-methyl-1,3-dioxolan-2-yl)ethanol (5754-32-5) + acetic anhydride (108-24-7) → 2-methyl-2(2-acetoxyethyl)-1,3-dioxolane (68039-72-5)

Guidance literature:

With Nafion-H; In dichloromethane; at 20 ℃; for 10h;

Reference yield:

2-methyl-1,3-dioxolane (497-26-7) + vinyl acetate (108-05-4,9003-20-7) → butane-1,4-diol diacetate (628-67-1) + 2-methyl-2(2-acetoxyethyl)-1,3-dioxolane (68039-72-5)

Guidance literature:

With di-tert-butyl peroxide; at 140 ℃; for 1h;

Reference yield:

2-methyl-1,3-dioxolane (497-26-7) → 2,2'-dimethyl-2,2'-bi-1,3-dioxolanyl (25062-94-6) + 2-methyl-2(2-acetoxyethyl)-1,3-dioxolane (68039-72-5)

Guidance literature:

With hydrogen; mercury; Heating; Irradiation;

DOI:10.1016/0040-4039(96)01536-5

upstream raw materials:

2-methyl-1,3-dioxolane

vinyl acetate

2-(2-methyl-1,3-dioxolan-2-yl)ethanol

acetic anhydride

Downstream raw materials:

1-acetoxybutan-3-one

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