Ethyl 2-bromododecanoate

Base Information

• Chemical Name: Ethyl 2-bromododecanoate
• CAS No.: 6974-87-4
• Molecular Formula: C14H27 Br O2
• Molecular Weight: 307.271
• European Community (EC) Number: 230-227-2
• NSC Number: 22012
• DSSTox Substance ID: DTXSID401284271
• Nikkaji Number: J266.031H
• Mol file: 6974-87-4.mol

Synonyms:Ethyl 2-bromododecanoate;6974-87-4;Ethyl alpha-bromo laurate;1-(2-furylsulfanyl)acetone;Dodecanoic acid, 2-bromo-, ethyl ester;2-Bromolauric acid ethyl ester;EINECS 230-227-2;Dodecanoic acid,2-bromo-, ethyl ester;Ethyl .alpha.-bromo laurate;SCHEMBL4704070;1-(2-furylsulfanyl)propan-2-one;DTXSID401284271;NSC22012;NSC 22012;NSC-22012;Dodecanoic acid,2-bromo-,ethyl ester;alpha-bromo-dodecanoic acid ethyl ester;FT-0625935;A836631

Chemical Property of Ethyl 2-bromododecanoate

Chemical Property:

• Vapor Pressure: 0.0011mmHg at 25°C
• Boiling Point: 300.8°C at 760 mmHg
• Flash Point: 150.7°C
• PSA: 26.30000
• Density: 1.11g/cm³
• LogP: 4.84380
• XLogP3: 6.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 12
• Exact Mass: 306.11944
• Heavy Atom Count: 17
• Complexity: 183

Purity/Quality:

98%min ^*data from raw suppliers

ETHYL ALPHA-BROMO LAURATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCC(C(=O)OCC)Br

Technology Process of Ethyl 2-bromododecanoate

There total 5 articles about Ethyl 2-bromododecanoate 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:

ethyl dibromoacetate (617-33-4) + tridecylborane (1188-96-1) → ethyl 2-bromododecanoate (6974-87-4)

Guidance literature:

With potassium tert-butylate; In tetrahydrofuran; tert-butyl alcohol;

DOI:10.1021/ja01009a048

Reference yield:

ethanol (64-17-5) + 2-bromododecanoic acid (111-56-8,201417-52-9) → ethyl 2-bromododecanoate (6974-87-4)

Guidance literature:

With naphthalene-2-sulfonate;

DOI:10.1021/ja01581a044

Reference yield:

→ ethyl 2-bromododecanoate (6974-87-4)

Guidance literature:

With tetrachloromethane; bromine;

upstream raw materials:

ethanol

2-bromododecanoic acid

lauric acid

ethyl dibromoacetate

Downstream raw materials:

2-[2-({3-[(E)-2-(7-Chloro-quinolin-2-yl)-vinyl]-phenylamino}-methyl)-phenoxy]-dodecanoic acid ethyl ester

2-{4-[4-(1-Carboxy-undecyloxy)-phenoxy]-phenoxy}-dodecanoic acid

α-[p-(1-cyclohexenyl)-phenoxy]-dodecanoic acid ethyl ester

Decylsuccinic acid

Refernces