9-Methyl-6-(propan-2-yl)-1,4-dioxaspiro[4.5]decane

Base Information

• Chemical Name: 9-Methyl-6-(propan-2-yl)-1,4-dioxaspiro[4.5]decane
• CAS No.: 944-00-3
• Molecular Formula: C12H22O2
• Molecular Weight: 198.305
• Hs Code.: 2932999099
• DSSTox Substance ID: DTXSID70518783
• Nikkaji Number: J130.880G
• Mol file: 944-00-3.mol

Synonyms:944-00-3;9-Methyl-6-(propan-2-yl)-1,4-dioxaspiro[4.5]decane;SCHEMBL18293420;DTXSID70518783

Chemical Property of 9-Methyl-6-(propan-2-yl)-1,4-dioxaspiro[4.5]decane

Chemical Property:

• PSA: 18.46000
• LogP: 2.82170
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 198.161979940
• Heavy Atom Count: 14
• Complexity: 195

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CCC(C2(C1)OCCO2)C(C)C

Technology Process of 9-Methyl-6-(propan-2-yl)-1,4-dioxaspiro[4.5]decane

There total 1 articles about 9-Methyl-6-(propan-2-yl)-1,4-dioxaspiro[4.5]decane 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:

→ menthone ethylene acetal (944-00-3)

Guidance literature:

Reference yield: 91.0%

menthone ethylene acetal (944-00-3) → Menthone (10458-14-7,17627-49-5,7786-64-3)

Guidance literature:

With aluminium trichloride; tetramethylammonium chlorochromate; In acetonitrile; for 0.75h; Heating;

DOI:10.1081/SCC-120016344

Reference yield: 37.0%

menthone ethylene acetal (944-00-3) + 2-Methylperbenzoic acid tert-butyl ester (22313-62-8) → 2-Methyl-benzoic acid 6-isopropyl-9-methyl-1,4-dioxa-spiro[4.5]dec-2-yl ester (112183-54-7)

Guidance literature:

With copper(I) bromide; In benzene; for 24h; Heating;

DOI:10.1055/s-1987-27991

Downstream raw materials:

2-Methyl-benzoic acid 6-isopropyl-9-methyl-1,4-dioxa-spiro[4.5]dec-2-yl ester

Menthone

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