Methyl 12-methyltetradecanoate

Base Information

• Chemical Name: Methyl 12-methyltetradecanoate
• CAS No.: 5129-66-8
• Molecular Formula: C₁₆H₃₂O₂
• Molecular Weight: 256.429
• DSSTox Substance ID: DTXSID20965581
• Nikkaji Number: J108.554I
• Wikidata: Q82947841
• Mol file: 5129-66-8.mol

Synonyms:METHYL 12-METHYLTETRADECANOATE;5129-66-8;Methyl 12-methylmyristate;12-Methyltetradecanoic acid methyl ester;Tetradecanoic acid, 12-methyl-, methyl ester;SCHEMBL2499676;DTXSID20965581;methyl 12-methyl tetradeca-noate;Methyl tetradecanoate, 12-methyl;CHEBI:142658;12-methylmyristic acid methyl ester;METHYL12-METHYLTETRADECANOATE;12-methyl Myristic Acid methyl ester;AKOS040755711;HY-W127497;CS-0185725;2819F46C-BD79-404E-8476-D485872B5904

Chemical Property of Methyl 12-methyltetradecanoate

Chemical Property:

• Appearance/Colour: Liquid
• Vapor Pressure: 0.0014mmHg at 25°C
• Boiling Point: 296.8 °C at 760 mmHg
• Flash Point: 134.7 °C
• PSA: 26.30000
• Density: 0.864 g/cm³
• LogP: 5.10650
• Storage Temp.: 2-8°C
• XLogP3: 6.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 13
• Exact Mass: 256.240230259
• Heavy Atom Count: 18
• Complexity: 190

Purity/Quality:

99% ^*data from raw suppliers

12-methyl Myristic Acid methyl ester ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCC(C)CCCCCCCCCCC(=O)OC
• Description: 12-methyl Myristic acid methyl ester is a methylated fatty acid methyl ester that has been found in vermicomposts of cattle manure, carica papaya leaves, and cuticular wax of K. africana. It is a volatile compound in lipid-lowering granulated tea. Levels of 12-methyl myristic acid methyl ester are decreased in T. cruzi treated with nifurtimox compared to non-treated controls. [Matreya, LLC. Catalog No. 1612]

Technology Process of Methyl 12-methyltetradecanoate

There total 8 articles about Methyl 12-methyltetradecanoate 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: 78.0%

methanol (67-56-1) + 12-methyltetradecanoic acid (5502-94-3,135096-46-7) → methyl 12-methyltetradecanoate (62691-05-8,5129-66-8)

Guidance literature:

With hydrogenchloride; methanol;

Reference yield:

3-Methyl-tetradecen-(3)-saeure-(14)-methylester (94462-92-7) → methyl 12-methyltetradecanoate (62691-05-8,5129-66-8)

Guidance literature:

With hydrogen; nickel;

Reference yield:

methyl 10-chloro-10-oxodecanoate (14065-32-8) → methyl 12-methyltetradecanoate (62691-05-8,5129-66-8)

Guidance literature:

Multi-step reaction with 3 steps

2: 65 percent / KOH, NH₂NH₂*H₂O / various solvent(s) / 6 h / 200 °C

3: 78 percent / 20percent HCl/CH₃OH

With hydrogenchloride; methanol; potassium hydroxide; hydrazine hydrate; In various solvent(s);

upstream raw materials:

3-Methyl-tetradecen-⁽³⁾-saeure-⁽¹⁴⁾-methylester

methanol

12-methyltetradecanoic acid

methyl 10-chloro-10-oxodecanoate

Downstream raw materials:

12-methyltetradecanoic acid

Refernces