2-Methyl-2-pentyl-1,3-dioxolane-4-methanol

Base Information

• Chemical Name: 2-Methyl-2-pentyl-1,3-dioxolane-4-methanol
• CAS No.: 4361-59-5
• Molecular Formula: C₁₀H₂₀O₃
• Molecular Weight: 188.267
• Hs Code.: 2932999099
• NSC Number: 27439
• UNII: 8W7D2CIN29
• DSSTox Substance ID: DTXSID80963088
• Nikkaji Number: J8.709B
• Wikidata: Q27271110
• Mol file: 4361-59-5.mol

Synonyms:Glyketal;4361-59-5;(2-methyl-2-pentyl-1,3-dioxolan-4-yl)methanol;2-Methyl-2-pentyl-1,3-dioxolane-4-methanol;2-Methyl-2-n-amyl-4-hydroxymethyl-1,3-dioxolane;NSC 27439;2-Heptanone, cyclic (hydroxymethyl)ethylene acetal;BRN 0108360;UNII-8W7D2CIN29;1,3-DIOXOLANE-4-METHANOL, 2-METHYL-2-PENTYL-;8W7D2CIN29;NSC-27439;4-19-00-00681 (Beilstein Handbook Reference);SCHEMBL6114044;DTXSID80963088;NSC27439;WLN: T5O COTJ B5 B1 D1Q;AKOS006277946;LS-62619;2-METHYL-2-PENTYL-1,3-DIOXOLAN-4-YLMETHANOL;Q27271110

Chemical Property of 2-Methyl-2-pentyl-1,3-dioxolane-4-methanol

Chemical Property:

• Vapor Pressure: 0.00194mmHg at 25°C
• Refractive Index: 1.4300 (estimate)
• Boiling Point: 259.1°Cat760mmHg
• Flash Point: 125.3°C
• PSA: 38.69000
• Density: 0.965g/cm³
• LogP: 1.69060
• Water Solubility.: 9.583g/L(25 oC)
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 188.14124450
• Heavy Atom Count: 13
• Complexity: 149

Purity/Quality:

99% ^*data from raw suppliers

2-METHYL-2-PENTYL-1,3-DIOXOLANE-4-METHANOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC1(OCC(O1)CO)C

Technology Process of 2-Methyl-2-pentyl-1,3-dioxolane-4-methanol

There total 1 articles about 2-Methyl-2-pentyl-1,3-dioxolane-4-methanol 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:

n-pentyl methyl ketone (110-43-0) + glycerol (56-81-5,25618-55-7,64333-26-2,8013-25-0) → (2-methyl-2-pentyl-[1,3]dioxolan-4-yl)-methanol (4361-59-5)

Guidance literature:

With hydrogenchloride; toluene;

DOI:10.1021/ja01178a009

upstream raw materials:

n-pentyl methyl ketone

glycerol