Hexadecyl tetradecanoate

Base Information

• Chemical Name: Hexadecyl tetradecanoate
• CAS No.: 2599-01-1
• Molecular Formula: C30H60O2
• Molecular Weight: 452.805
• Hs Code.: 2915900090
• European Community (EC) Number: 220-001-1
• UNII: 7OPL833Q4D
• DSSTox Substance ID: DTXSID1062546
• Nikkaji Number: J111.011J
• Wikidata: Q27268650
• RXCUI: 1306180
• Metabolomics Workbench ID: 3683
• Mol file: 2599-01-1.mol

Synonyms:Hexadecyl tetradecanoate;Palmityl myristate;Cetyl myristate;2599-01-1;Tetradecanoic acid, hexadecyl ester;Hexadecyl myristate;hexadecanyl tetradecanoate;Myristic acid, hexadecyl ester;7OPL833Q4D;WE(16:0/14:0);UNII-7OPL833Q4D;Schercemol CM;Hexadecylmyristate;Tetradecanoic acid,hexadecyl ester;myristic acid cetyl ester;SCHEMBL59908;palmityl myristate, AldrichCPR;CETYL MYRISTATE [INCI];DTXSID1062546;MYRISTIC ACID, CETYL ESTER;CAA59901;EINECS 220-001-1;LMFA07010038;MFCD00056217;AKOS022183496;AS-62081;FT-0629052;J-016214;Q27268650

Chemical Property of Hexadecyl tetradecanoate

Chemical Property:

• Vapor Pressure: 1.47E-09mmHg at 25°C
• Refractive Index: 1.454
• Boiling Point: 484.942 °C at 760 mmHg
• Flash Point: 255.522 °C
• PSA: 26.30000
• Density: 0.859 g/cm³
• LogP: 10.71200
• Storage Temp.: -20°C
• Solubility.: Chloroform (Slightly), Ethyl Acetate (Slightly)
• XLogP3: 14.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 28
• Exact Mass: 452.45933115
• Heavy Atom Count: 32
• Complexity: 353

Purity/Quality:

99%, ^*data from raw suppliers

Palmityl Myristate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Other Classes -> Esters, Other
• Canonical SMILES: CCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCC
• Uses: Palmityl Myristate is a wax ester of myristic acid used in cosmetics as skin conditioning agents.

Technology Process of Hexadecyl tetradecanoate

There total 4 articles about Hexadecyl tetradecanoate 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: 99.5%

1-Hexadecanol (36653-82-4,124-29-8) + n-tetradecanoic acid (544-63-8) → tetradecanoic acid hexadecyl ester (2599-01-1)

Guidance literature:

With zirconium(IV) oxychloride; In 1,3,5-trimethyl-benzene; at 162 ℃; for 24h;

DOI:10.1055/s-2005-869951

Reference yield:

1-Hexadecanol (36653-82-4,124-29-8) + n-tetradecanoic acid (544-63-8) + 1-hexadecylcarboxylic acid (57-10-3) → tetradecanoic acid hexadecyl ester (2599-01-1) + cetyl palmitate (540-10-3)

Guidance literature:

With phosphoric acid; In hexane; water; for 8.5h; Product distribution / selectivity; Heating / reflux;

Reference yield:

1-Hexadecanol (36653-82-4,124-29-8) + tetradecanoyl chloride (112-64-1) → tetradecanoic acid hexadecyl ester (2599-01-1)

Guidance literature:

upstream raw materials:

1-Hexadecanol

n-tetradecanoic acid

tetradecanoyl chloride

1-hexadecylcarboxylic acid

Refernces

• 1、 -. "PROCESS FOR PRODUCING CARBOXYLIC ACID ESTER AND ESTERIFICATION CATALYST". Page/Page column 12-13. . Retrieved 2008/06/13.
• 2、 -. "Synthesis of ester linked long chain alkyl moieties". Page/Page column 1. . Retrieved 2008/06/13.