Methyl 14-methylpentadecanoate

Base Information

• Chemical Name: Methyl 14-methylpentadecanoate
• CAS No.: 5129-60-2
• Molecular Formula: C17H34O2
• Molecular Weight: 270.45
• Hs Code.: 2915900090
• DSSTox Substance ID: DTXSID80199289
• Nikkaji Number: J47.594G
• Wikidata: Q63395534
• Mol file: 5129-60-2.mol

Synonyms:Methyl 14-methylpentadecanoate;5129-60-2;Pentadecanoic acid, 14-methyl-, methyl ester;14-Methylpentadecanoic acid methyl ester;Methyl isohexadecanoate;SCHEMBL2259435;DTXSID80199289;Methyl 14-methylpentadecanoate #;CHEBI:157641;METHYL14-METHYLPENTADECANOATE;AKOS040755719;14-methyl Pentadecanoic Acid methyl ester;FT-0751973;B960C1EE-F6EB-4C1B-A297-24FE1DAB2747;Q63395534

Chemical Property of Methyl 14-methylpentadecanoate

Chemical Property:

• Vapor Pressure: 0.000549mmHg at 25°C
• Boiling Point: 311.8°C at 760 mmHg
• Flash Point: 144.1°C
• PSA: 26.30000
• Density: 0.864g/cm³
• LogP: 5.49660
• Storage Temp.: 2-8°C
• XLogP3: 7.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 14
• Exact Mass: 270.255880323
• Heavy Atom Count: 19
• Complexity: 199

Purity/Quality:

95% ^*data from raw suppliers

14-methyl Pentadecanoic Acid methyl ester ≥98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CCCCCCCCCCCCC(=O)OC
• Description: 14-methyl Pentadecanoic acid methyl ester is a methylated fatty acid methyl ester that has been found in S. zeai sea sponges as the fatty acyl component of zeamide, A. indica leaf extract, and C. vulgaris and H. pluvialis microalgae. It is a major component of the vancomycin-induced biofilm produced by vancomycin-resistant S. aureus (VRSA). 14-methyl Pentadecanoic acid methyl ester has been used as a standard for the quantification of 14-methyl pentadecanoic acid in various foods by GC-MS. [Matreya, LLC. Catalog No. 1601]

Technology Process of Methyl 14-methylpentadecanoate

There total 3 articles about Methyl 14-methylpentadecanoate 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:

methanol (67-56-1) + psammaplysin N → methyl 14-methylpentadecanoate (5129-60-2)

Guidance literature:

With hydrogenchloride; at 70 ℃; for 16h;

DOI:10.1021/np300560b

Reference yield:

diazomethane (186581-53-3,908094-01-9,334-88-3) → methyl 14-methylpentadecanoate (5129-60-2)

Guidance literature:

With diethyl ether;

Reference yield:

→ methyl 14-methylpentadecanoate (5129-60-2)

Guidance literature:

entspr. Aldehyd (isol. aus Rinderherzmuskel), 1) Ag2O (Oxid. zu Saeure), 2) Ueberfuehrg. in Methylester;

DOI:10.1016/0005-2760(71)90137-8

upstream raw materials:

diazomethane

methanol

Refernces

• 1、 Mudianta, I Wayan,Skinner-Adams, Tina,Andrews, Katherine T.,Davis, Rohan A.,Hadi, Tri A.,Hayes, Patricia Y.,Garson, Mary J.. "Psammaplysin derivatives from the balinese marine sponge Aplysinella strongylata". . p. 2132 - 2143. Retrieved 2013/02/25.