3-((L-Menthyl)oxy)propane-1,2-diol

Base Information

• Chemical Name: 3-((L-Menthyl)oxy)propane-1,2-diol
• CAS No.: 87061-04-9
• Molecular Formula: C₁₃H₂₆O₃
• Molecular Weight: 230.348
• UNII: KD6TZ2QICH
• DSSTox Substance ID: DTXSID80174859
• Nikkaji Number: J716.641I
• Wikidata: Q27282195
• RXCUI: 1314260
• Mol file: 87061-04-9.mol

Synonyms:Menthoxypropane diol;3-((L-Menthyl)oxy)propane-1,2-diol;3-(l-Menthoxy)propane-1,2-diol;CA 10;cooling agent 10;KD6TZ2QICH;UNII-KD6TZ2QICH;FEMA No. 3784;3-(1-Menthoxy) propane-1,2-diol [FHFI];1,2-Propanediol, 3-(((1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl)oxy)-;3-((1R,2S,5R)-2-3-((1R,2S,5R)-2-Isopropyl-5-methyl-cyclohexoxy)propane-1,2-diol;207792-35-6;3-((1R,2S,5R)-2-Isopropyl-5-methyl-cyclohexoxy)(+-)-propane-1,2-diol;3-[(L-menthyl)oxy]propane-1,2-diol;SCHEMBL1617431;DTXSID80174859;MENTHOXYPROPANEDIOL [INCI];3-(l-Menthoxy)propan-1,2-diol;MENTHOXYPROPANEDIOL [WHO-DD];3-(1-MENTHOXY)PROPANE-1,2-DIOL [FHFI];Q27282195;3-((1R,2S,5R)-2-ISOPROPYL-5-METHYL-CYCLOHEXOXY)(+/-)-PROPANE-1,2-DIOL

Chemical Property of 3-((L-Menthyl)oxy)propane-1,2-diol

Chemical Property:

• Vapor Pressure: 9.88E-07mmHg at 25°C
• Refractive Index: 1.474-1.480
• Boiling Point: 362.8 °C at 760 mmHg
• PKA: 13.65±0.20(Predicted)
• Flash Point: 173.2 °C
• PSA: 49.69000
• Density: 1 g/cm³
• LogP: 1.81700
• Water Solubility.: 2.27g/L at 20℃
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 230.18819469
• Heavy Atom Count: 16
• Complexity: 194

Purity/Quality:

99% ^*data from raw suppliers

Menthoxypropane-1,2-diol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CCC(C(C1)OCC(CO)O)C(C)C
• Isomeric SMILES: C[C@@H]1CC[C@H]([C@@H](C1)OCC(CO)O)C(C)C
• Uses: Menthoxypropane-1,2-diol, is a Cyclohexane derivative are disclosed in a variety of tech. products, household products, or in cosmetic and pharmaceutical compounds.?The substances are well tolerated and characterized by their good biodegradability. Menthoxypropanediol is used to mask odor and leave the skin feeling refreshed, it is a synthetic menthol derivative.

Technology Process of 3-((L-Menthyl)oxy)propane-1,2-diol

There total 3 articles about 3-((L-Menthyl)oxy)propane-1,2-diol 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: 97.7%

1,2-cyclohexyloxy-3-L-menthoxypropane (249297-16-3) → Cooling-agent 10 (87061-04-9)

Guidance literature:

With hydrogenchloride; In ethanol; water; Reflux; Inert atmosphere;

Reference yield: 94.2%

→ 3-(2-isopropyl-5-methylcyclohexyloxy)propane-1,2-diol (87061-04-9)

Guidance literature:

Reference yield: 78.06%

→ (2S)-3-l-menthoxypropane-1,2-diol (87061-04-9)

Guidance literature:

upstream raw materials:

1,2-cyclohexyloxy-3-L-menthoxypropane

Refernces

• 1、 -. "Process for producing 3-1-menthoxypropane-1,2-diol". Page column 15. . Retrieved 2008/06/13.
• 2、 -. "3-Levo-Menthoxypropane-1,2-diol". . . Retrieved 2008/06/13.