Dimethyl undecanedioate

Base Information

• Chemical Name: Dimethyl undecanedioate
• CAS No.: 4567-98-0
• Molecular Formula: C13H24 O4
• Molecular Weight: 244.331
• Hs Code.: 2917190090
• European Community (EC) Number: 224-943-4
• NSC Number: 152029
• DSSTox Substance ID: DTXSID90196587
• Nikkaji Number: J46.701D
• Wikidata: Q63409376
• Mol file: 4567-98-0.mol

Synonyms:Dimethyl undecanedioate;4567-98-0;undecanedioic acid dimethyl ester;Undecanedioic acid, dimethyl ester;EINECS 224-943-4;Dimethylundecanedioate;Dimethyl 1,9-nonanedicarboxylate;1,11-dimethyl undecanedioate;SCHEMBL4469269;DTXSID90196587;Dimethyl ester of undecanedioic acid;NSC152029;NSC 152029;NSC-152029;AS-80931;FT-0625051;D97181;Dimethyl undecanedioate, technical, >=90% (GC);Q63409376

Chemical Property of Dimethyl undecanedioate

Chemical Property:

• Vapor Pressure: 0.00244mmHg at 25°C
• Melting Point: 17-19 °C
• Refractive Index: n20/D 1.440
• Boiling Point: 123-124 °C2 mm Hg(lit.)
• Flash Point: 129.2°C
• PSA: 52.60000
• Density: 0.976g/cm³
• LogP: 2.84330
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 12
• Exact Mass: 244.16745924
• Heavy Atom Count: 17
• Complexity: 192

Purity/Quality:

98%,99%, ^*data from raw suppliers

DIMETHYL UNDECANEDIOATE Aldrich ^*data from reagent suppliers

Safty Information:

• Safety Statements: S24/25:Avoid contact with skin and eyes.

MSDS Files:

Total 1 MSDS from other Authors

Useful:

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

Technology Process of Dimethyl undecanedioate

There total 16 articles about Dimethyl undecanedioate 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: 100.0%

methanol (67-56-1) + undecanedioic acid (1852-04-6) → dimethyl undecanedioate (4567-98-0)

Guidance literature:

With boron trifluoride; at 65 ℃; for 0.333333h;

DOI:10.1021/ac049919h

Reference yield: 85.0%

methanol (67-56-1) + 2-nitrocycloundecanone (141882-58-8) → dimethyl undecanedioate (4567-98-0)

Guidance literature:

With dipotassium peroxodisulfate; sulfuric acid; at 80 ℃; for 2h;

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

Reference yield: 71.0%

methanol (67-56-1) + 11-benzenesulfonyl-11-nitroundecanoic acid methyl ester → dimethyl undecanedioate (4567-98-0)

Guidance literature:

methanol; 11-benzenesulfonyl-11-nitroundecanoic acid methyl ester; With 1,8-diazabicyclo[5.4.0]undec-7-ene; In dichloromethane; at 0 ℃; for 0.166667h;

With ozone; In dichloromethane; at -78 ℃; for 0.166667h;

DOI:10.1016/j.tet.2019.130883

upstream raw materials:

methanol

azelaic acid

undecanedioic acid

diazomethane

Downstream raw materials:

undecanedioic acid

Refernces

• 1、 Yoo, Jae Won,Seo, Youngran,Park, Jong Beom,Kim, Young Gyu. "Two-way homologation of aliphatic aldehydes: Both one-carbon shortening and lengthening via the same intermediate". . . Retrieved 2020/01/13.
• 2、 Imai, Takashi,Matsumura, Takayuki,Mayer-Lambertz, Sabine,Wells, Christine A.,Ishikawa, Eri,Butcher, Suzanne K.,Barnett, Timothy C.,Walker, Mark J.,Imamura, Akihiro,Ishida, Hideharu,Ikebe, Tadayoshi,Miyamoto, Tomofumi,Ato, Manabu,Ohga, Shouichi,Lepenies, Bernd,Van Sorge, Nina M.,Yamasaki, Sho. "Lipoteichoic acid anchor triggers Mincle to drive protective immunity against invasive group A Streptococcus infection". . p. E10662 - E10671. Retrieved 2018/11/20.