Dimethyl Pentadecanedioate

Base Information

• Chemical Name: Dimethyl Pentadecanedioate
• CAS No.: 36575-82-3
• Molecular Formula: C17H32 O4
• Molecular Weight: 300.439
• Hs Code.: 2917190090
• DSSTox Substance ID: DTXSID80465219
• Nikkaji Number: J106.031G
• Wikidata: Q82291011
• Mol file: 36575-82-3.mol

Synonyms:Dimethyl Pentadecanedioate;36575-82-3;Pentadecanedioic acid,1,15-dimethyl ester;dimethyl n-pentadecanedioate;SCHEMBL494112;DIMETHYLPENTADECANEDIOATE;dimethyl 1,15-pentadecandioate;DTXSID80465219;IAYJBOCIXHISNO-UHFFFAOYSA-N;1,15-DIMETHYL PENTADECANEDIOATE;BS-48954;F71441

Chemical Property of Dimethyl Pentadecanedioate

Chemical Property:

• PSA: 52.60000
• LogP: 4.40370
• XLogP3: 5.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 16
• Exact Mass: 300.23005950
• Heavy Atom Count: 21
• Complexity: 238

Purity/Quality:

98%, ^*data from raw suppliers

DIMETHYL PENTADECANEDIOATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)CCCCCCCCCCCCCC(=O)OC

Technology Process of Dimethyl Pentadecanedioate

There total 8 articles about Dimethyl Pentadecanedioate 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: 99.0%

methanol (67-56-1) + pentadecanedioic acid (1460-18-0) → dimethyl pentadecanedioate (36575-82-3)

Guidance literature:

With toluene-4-sulfonic acid; for 17h; Heating;

DOI:10.1016/j.tetlet.2007.11.065

Reference yield: 80.0%

4-oxopentadecanedioic acid (15210-29-4) → dimethyl pentadecanedioate (36575-82-3)

Guidance literature:

With potassium hydroxide; hydrazine hydrate; In ethylene glycol;

Reference yield: 78.0%

methanol (67-56-1) + 2-nitrocyclopentadecanone (128780-80-3) → dimethyl pentadecanedioate (36575-82-3)

Guidance literature:

With dipotassium peroxodisulfate; sulfuric acid; at 80 ℃; for 5h;

DOI:10.1016/S0040-4020(97)10052-7

upstream raw materials:

6-oxo-pentadecanedioic acid dimethyl ester

cyclopentadecyne

methanol

2-nitrocyclopentadecanone

Downstream raw materials:

2-hydroxycyclopentadecanone

cyclopentadecanone

methyl 15-hydroxypentadecanoate

Refernces

• 1、 Phung, Peter,Rowlands, William N.,Thiyakesan, Appadurai,Benndorf, Paul,Masters, Anthony F.,Maschmeyer, Thomas. "Metal/bromide autoxidation of triglycerides for the preparation of FAMES to improve the cold-flow characteristics of biodiesel". . p. 162 - 168. Retrieved 2014/07/07.
• 2、 Hisanaga, Yusuke,Asumi, Yuya,Takahashi, Masaki,Shimizu, Yasuhiro,Mase, Nobuyuki,Yoda, Hidemi,Takabe, Kunihiko. "A practical synthesis of (E)-2-cyclopentadecen-1-one: an important precursor of macrocyclic muscone". . p. 548 - 551. Retrieved 2008/04/13.