1,4-Dioxaspiro[4.5]decane-2-methanol, 9-methyl-6-(1-methylethyl)-

Base Information

• Chemical Name: 1,4-Dioxaspiro[4.5]decane-2-methanol, 9-methyl-6-(1-methylethyl)-
• CAS No.: 63187-91-7
• Molecular Formula: C13H24O3
• Molecular Weight: 228.332
• Hs Code.: 2932999099
• European Community (EC) Number: 408-200-3,613-178-5
• UNII: 7QQ1EE6RCP
• DSSTox Substance ID: DTXSID20866983
• Nikkaji Number: J1.087.004F
• Wikidata: Q27077744
• Pharos Ligand ID: MNZ4AQXZY17K
• Metabolomics Workbench ID: 47211
• Mol file: 63187-91-7.mol

Synonyms:63187-91-7;Menthone 1,2-glycerol ketal;Frescolat MGA;6-Isopropyl-9-methyl-1,4-dioxaspiro[4.5]decane-2-methanol;1,4-Dioxaspiro[4.5]decane-2-methanol, 9-methyl-6-(1-methylethyl)-;Menthoneglycerinacetal;Menthone 1,2-glyceryl ketal;menthone glyceryl ketal;Menthone glycerin acetal;UNII-7QQ1EE6RCP;6-Isopropyl-9-methyl-1,4-dioxaspiro(4.5)decane-2-methanol;7QQ1EE6RCP;(9-methyl-6-propan-2-yl-1,4-dioxaspiro[4.5]decan-3-yl)methanol;Menthone 1,2-glycerol ketal, (+/-)-;1,4-Dioxaspiro(4.5)decane-2-methanol, 9-methyl-6-(1-methylethyl)-;EC 408-200-3;(6-isopropyl-9-methyl-1,4-dioxaspiro[4.5]decan-2-yl)methanol;(9-methyl-6-propan-2-yl-1,4-dioxaspiro[4.5]decan-2-yl)methanol;[9-methyl-6-(propan-2-yl)-1,4-dioxaspiro[4.5]decan-2-yl]methanol;9-Methyl-6-(1-methylethyl)-1,4-dioxaspiro(4.5)decane-2-methanol;2-hydroxymethyl-9-methyl-6-(1-methylethyl)-1,4-dioxaspiro(4.5)decane;2-hydroxymethyl-9-methyl-6-(1-methylethyl)-1,4-dioxaspiro[4.5]decane;starbld0009751;D09QSY;SCHEMBL169625;GTPL2465;FEMA NO. 3808;DL-Menthone-1,2-glycerol ketal;FEMA 3807;FEMA 3808;DTXSID20866983;CHEBI:169866;d,l-Menthone 1,2-glycerol ketal;FRESCOLAT, TYPE MGA RACEMIC;(+/-)-menthone 1,2-glycerol ketal;dextro,laevo-menthone glycerine acetal;AKOS015908506;AC-9867;MENTHONE GLYCERIN ACETAL [INCI];DL-MENTHONE 1,2-GLYCEROL KETAL;CS-0454364;F-165;FT-0626550;E79266;D,L-MENTHONE 1,2-GLYCEROL KETAL [FHFI];DL-MENTHONE (+/-)-1,2-GLYCEROL KETAL;Q27077744;6-Isopropyl-9-methyl-1,4-dioxaspiro(4,5)decane-2-methanol;6-isopropyl-9-methyl-1,4-dioxaspiro-[4,5]-decane-2-methanol;(9-methyl-6-propan-2-yl-1,4-dioxaspiro[4.5]decan-3-yl)methanol.;1,4-dioxaspiro[4.5]decano-2-metanol, 9-metil-6-(1-metiletil)-;2-Hydroxymethyl-6-isopropyl-9-methyl-1,4-dioxaspiro[4.5]decane;9-Methyl-6-(1-methylethyl)-1,4-dioxaspiro[4.5]decane-2-methanol, 9CI

Chemical Property of 1,4-Dioxaspiro[4.5]decane-2-methanol, 9-methyl-6-(1-methylethyl)-

Chemical Property:

• Appearance/Colour: clear colourless viscous liquid
• Vapor Pressure: 2.15E-05mmHg at 25°C
• Refractive Index: 1.488
• Boiling Point: 322.9 ºC at 760 mmHg
• PKA: 14.21±0.10(Predicted)
• Flash Point: 159.7 ºC
• PSA: 38.69000
• Density: 1.04 g/cm³
• LogP: 2.18260
• Water Solubility.: 1.2g/L at 20℃
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 228.17254462
• Heavy Atom Count: 16
• Complexity: 241

Purity/Quality:

99% ^*data from raw suppliers

L-MENTHONE-1,2-GLYCEROL KETAL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 38-41-52/53
• Safety Statements: 26-37/39-61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CCC(C2(C1)OCC(O2)CO)C(C)C
• Uses: is therapeutic agent containing TRPM8 agonist for treating gastrointestinal disorders and abdominal pain. Menthone 1,2-glycerol ketal is used for adding fragrance, and to leave the skin feeling refreshed and cool. It is a menthol derivative that can be naturally obtained or synthetically manufactured.

Technology Process of 1,4-Dioxaspiro[4.5]decane-2-methanol, 9-methyl-6-(1-methylethyl)-

There total 1 articles about 1,4-Dioxaspiro[4.5]decane-2-methanol, 9-methyl-6-(1-methylethyl)- 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:

→ methone glycerin acetal (63187-91-7)

Guidance literature:

d,l-Menthon(I), Glycerin;

Reference yield:

methanol (67-56-1) + methone glycerin acetal (63187-91-7) → menthone dimethyl ketal + Menthone (10458-14-7,17627-49-5,7786-64-3)

Guidance literature:

methone glycerin acetal; With 1,2-Epoxydecane; at 25 ℃;

boron trifluoride diethyl etherate; at 25 - 60 ℃; for 0.333333h;

methanol; toluene-4-sulfonic acid; at 20 ℃; for 96h;

Downstream raw materials:

Menthone