Ethyl 9-bromononanoate

Base Information

• Chemical Name: Ethyl 9-bromononanoate
• CAS No.: 28598-81-4
• Molecular Formula: C11H21 Br O2
• Molecular Weight: 265.191
• Hs Code.: 2915900090
• European Community (EC) Number: 220-732-6,926-337-1,678-093-8
• DSSTox Substance ID: DTXSID90951456
• Mol file: 28598-81-4.mol

Synonyms:Ethyl 9-bromononanoate;28598-81-4;Nonanoic acid, 9-bromo-, ethyl ester;2881-62-1;9-Bromo-nonanoic acid ethyl ester;MFCD06797065;9-Bromononanoic acid, ethyl ester;Ethyl 9-bromononanoate #;SCHEMBL1005765;9-Bromononanoic Acid Ethyl Ester;DTXSID90951456;AKOS022184013;SY054080;B2324;CS-0151580;FT-0638788;T70716;A819505;ethyl?1-(3-isopropylphenyl)-1H-1,2,4-triazole-3-carboxylate

Chemical Property of Ethyl 9-bromononanoate

Chemical Property:

• Vapor Pressure: 0.00287mmHg at 25°C
• Refractive Index: 1.463
• Boiling Point: 180 °C / 30mmHg
• Flash Point: 149.5°C
• PSA: 26.30000
• Density: 1.17
• LogP: 3.67510
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 10
• Exact Mass: 264.07249
• Heavy Atom Count: 14
• Complexity: 137

Purity/Quality:

98%, ^*data from raw suppliers

Ethyl 9-Bromononanoate >95.0%(GC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Metals -> Metals, Inorganic Compounds
• Canonical SMILES: CCOC(=O)CCCCCCCCBr

Technology Process of Ethyl 9-bromononanoate

There total 5 articles about Ethyl 9-bromononanoate 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:

ethanol (64-17-5) + 9-bromononanoic acid (41059-02-3) → ethyl 9-bromononanoate (28598-81-4)

Guidance literature:

With sulfuric acid;

Reference yield:

monoethyl sebacate (693-55-0) → ethyl 9-bromononanoate (28598-81-4)

Guidance literature:

Multistep reaction; (i) Ag₂O, (ii) Br₂;

Reference yield:

1,7-dibromoheptane (4549-31-9) → ethyl 9-bromononanoate (28598-81-4)

Guidance literature:

Multi-step reaction with 3 steps

1: ethanol

2: aqueous hydrobromic acid

3: sulfuric acid

With ethanol; sulfuric acid; hydrogen bromide;

upstream raw materials:

ethanol

9-bromononanoic acid

monoethyl sebacate

1,7-dibromoheptane

Downstream raw materials:

10-(2-Chloro-benzyl)-11-oxo-10-phenyl-dodecanoic acid

2,2-diphenyl-undecanedioic acid dimethyl ester

10-cyano-10,10-diphenyl-decanoic acid

2,2-diphenyl-undecanedioic acid

Refernces

• 1、 Mostyn, Shannon N.,Carland, Jane E.,Shimmon, Susan,Ryan, Renae M.,Rawling, Tristan,Vandenberg, Robert J.. "Synthesis and Characterization of Novel Acyl-Glycine Inhibitors of GlyT2". . p. 1949 - 1959. Retrieved 2017/09/26.
• 2、 -. "ALBUMIN-BINDING COMPOUNDS". Page/Page column 33-34. . Retrieved 2010/02/15.