N-Ethyl-p-menthane-3-carboxamide

Base Information

• Chemical Name: N-Ethyl-p-menthane-3-carboxamide
• CAS No.: 39711-79-0
• Molecular Formula: C13H25NO
• Molecular Weight: 211.348
• Hs Code.: 29242990
• European Community (EC) Number: 254-599-0
• UNII: 6S7S02945H
• DSSTox Substance ID: DTXSID5047039
• Nikkaji Number: J261.435I
• Wikidata: Q27089232
• RXCUI: 1358486
• Pharos Ligand ID: CG93QRG59UFZ
• Metabolomics Workbench ID: 47952
• ChEMBL ID: CHEMBL3185043
• Mol file: 39711-79-0.mol

Synonyms:39711-79-0;N-Ethyl-p-menthane-3-carboxamide;N-Ethyl-2-isopropyl-5-methylcyclohexanecarboxamide;Ethyl menthane carboxamide;WS 3;WS-3;N-Ethyl-2-(isopropyl)-5-methylcyclohexanecarboxamide;Cyclohexanecarboxamide, N-ethyl-5-methyl-2-(1-methylethyl)-;FEMA No. 3455;N-ethyl-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide;N-Ethyl-4-menthane-3-carboxamide;N-Ethyl-2-isopropyl-5-methylcyclohexane carboxamide;N-Ethyl-5-methyl-2-(1-methylethyl)cyclohexanecarboxamide;EINECS 254-599-0;TRPM8 antagonist WS-3;N-Ethyl 5-methyl-2-iso-propylcyclohexanecarboxamide;N-Ethyl-5-methyl-2-(1-methylethyl)-cyclohexanecarboxamide;DTXSID5047039;UNII-6S7S02945H;MFCD00130071;6S7S02945H;Framidice 3;menthol carboxamide;TRPM8 agonist WS-3;WS-3 (cooling agent);Menthol Carboxamide WS-3;D0T6XB;SCHEMBL33290;GTPL2475;CHEMBL3185043;DTXCID3027039;N-Ethyl-p-methane-3-carboxamide;CHEBI:168845;Tox21_302336;s6122;AKOS015842655;CS-W015041;ETHYL MENTHANE CARBOXAMIDE [MI];HY-W014325;LS-2732;ETHYL MENTHANE CARBOXAMIDE [INCI];NCGC00256167-01;AS-15567;SY013238;CAS-39711-79-0;AM20070545;E0796;FT-0639568;W-100;O12022;A824701;Nocarboxamida, N-etil-5-metil-2-(1-metiletil)-;W-106408;Q27089232;N- ethyl- 2- (isopropyl)- 5- methylcyclohexanecarboxamide;N-Ethyl-5-methyl-2-(1-methylethyl)-cyclohexane-carboxamide;N-ethyl-5-methyl-2-(propan-2-yl)cyclohexane-1-carboxamide;N-ethyl-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide.;N-Ethyl-2-isopropyl-5-methylcyclohexanecarboxamide, 99%, FG;ETHYL-2-ISOPROPYL-5-METHYLCYCLOHEXANE CARBOXAMIDE [FHFI];N-Ethyl-p-methane-3-carboxamide, Ethyl menthane carboxamide, Framidice 3, Menthol Carboxamide WS-3

Chemical Property of N-Ethyl-p-menthane-3-carboxamide

Chemical Property:

• Appearance/Colour: white crystalline powder
• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 87-102 °C
• Refractive Index: 1.454
• Boiling Point: 340.5 °C at 760 mmHg
• PKA: 16.27±0.60(Predicted)
• Flash Point: 205.7 °C
• PSA: 29.10000
• Density: 0.898 g/cm³
• LogP: 3.22180
• Storage Temp.: Store at RT
• Water Solubility.: insoluble
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 211.193614421
• Heavy Atom Count: 15
• Complexity: 213

Purity/Quality:

99%, ^*data from raw suppliers

WS 3 ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi,Xn
• Hazard Codes: Xi,Xn
• Statements: 36-41-22
• Safety Statements: 39-26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCNC(=O)C1CC(CCC1C(C)C)C
• Uses: WS 3 is a selective transient receptor potential melastatin-8 ligand. Physiological coolant in foods, beverages, toiletries, cosmetics and pharmaceuticals.

Technology Process of N-Ethyl-p-menthane-3-carboxamide

There total 1 articles about N-Ethyl-p-menthane-3-carboxamide 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:

→ WS-3 (39711-79-0)

Guidance literature:

Reference yield: 61.0%

WS-3 (39711-79-0) → menthanecarboxylic acid (39668-86-5)

Guidance literature:

With sulfuric acid; water; sodium nitrite; at 75 ℃;

Downstream raw materials:

menthanecarboxylic acid

Refernces