2-Bromoethyl dodecanoate

Base Information

• Chemical Name: 2-Bromoethyl dodecanoate
• CAS No.: 6309-50-8
• Molecular Formula: C14H27 Br O2
• Molecular Weight: 307.271
• NSC Number: 42575
• DSSTox Substance ID: DTXSID20285655
• Wikidata: Q82021110
• Mol file: 6309-50-8.mol

Synonyms:6309-50-8;2-bromoethyl dodecanoate;NSC42575;SCHEMBL11791762;DTXSID20285655;NSC-42575

Chemical Property of 2-Bromoethyl dodecanoate

Chemical Property:

• Vapor Pressure: 5.63E-05mmHg at 25°C
• Boiling Point: 346.8°C at 760 mmHg
• Flash Point: 181.2°C
• Density: 1.112g/cm³
• XLogP3: 6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 13
• Exact Mass: 306.11944
• Heavy Atom Count: 17
• Complexity: 172

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCC(=O)OCCBr

Technology Process of 2-Bromoethyl dodecanoate

There total 3 articles about 2-Bromoethyl dodecanoate 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: 95.0%

lauric acid (143-07-7) + 2-bromoethanol (540-51-2) → 2-bromoethyl dodecanoate (6309-50-8)

Guidance literature:

With sulfuric acid; at 60 ℃; for 6h;

Reference yield: 73.0%

n-dodecanoyl chloride (112-16-3) + 2-bromoethanol (540-51-2) → 2-bromoethyl dodecanoate (6309-50-8)

Guidance literature:

With triethylamine; In chloroform; for 3h; Ambient temperature;

DOI:10.1002/jps.2600771115

Reference yield:

→ 2-bromoethyl dodecanoate (6309-50-8)

Guidance literature:

Br-(CH2)2-OH, entspr. Saeure;

upstream raw materials:

lauric acid

2-bromoethanol

n-dodecanoyl chloride

Downstream raw materials:

(2-lauroyloxy-ethyl)-phosphonic acid diethyl ester

lauric acid

Refernces

• 1、 Arif, Rabia,Mir, Ab Waheed,Shaheen, Arifa,Wani, Mohammad Rafiq. "Synthesis, micellization and cytotoxic studies of ester-functionalized imidazolium gemini surfactants". . . Retrieved 2021/12/14.
• 2、 Ahmad, Ishtiaque,Patial, Pankaj,Kaur, Charanjeet,Kaur, Satindar. "Cationic imidazolium monomeric surfactants: Their synthesis and surface active properties". . p. 269 - 277. Retrieved 2014/03/21.