Methyl 10-bromodecanoate

Base Information

• Chemical Name: Methyl 10-bromodecanoate
• CAS No.: 26825-94-5
• Molecular Formula: C11H21 Br O2
• Molecular Weight: 265.191
• Hs Code.: 2915900090
• European Community (EC) Number: 839-773-1
• DSSTox Substance ID: DTXSID80339143
• Nikkaji Number: J108.574C
• Wikidata: Q82107967
• Mol file: 26825-94-5.mol

Synonyms:Methyl 10-bromodecanoate;26825-94-5;Decanoic acid, 10-bromo-, methyl ester;10-Bromo-decanoic acid methyl ester;10-bromodecanoic acid methyl ester;methyl-10bromodecanoate;Methyl-10-bromodecanoate;SCHEMBL454130;DTXSID80339143;AKOS015950683;AB92453;BS-23595;CS-0129053;D94757;Methyl 10-bromodecanoate, 90%, technical grade;J-016563

Chemical Property of Methyl 10-bromodecanoate

Chemical Property:

• Refractive Index: n20/D 1.464(lit.)
• Boiling Point: 186 °C(lit.)
• Flash Point: >230 °F
• PSA: 26.30000
• Density: 1.137 g/mL at 25 °C(lit.)
• LogP: 3.67510
• XLogP3: 4
• 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%,99%, ^*data from raw suppliers

10-Bromo-decanoicacidmethylester 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)CCCCCCCCCBr

Technology Process of Methyl 10-bromodecanoate

There total 9 articles about Methyl 10-bromodecanoate 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: 98.0%

methyl 10-hydroxydecanoate (2640-94-0) → 10-bromodecanoic acid methyl ester (26825-94-5)

Guidance literature:

With carbon tetrabromide; Cu(tmp)(BINAP)BF₄; sodium bromide; In N,N-dimethyl-formamide; for 24h; Time; Catalytic behavior; UV-irradiation; Inert atmosphere;

DOI:10.3762/bjoc.14.251

Reference yield: 94.0%

methanol (67-56-1) + 10-bromodecanoic acid (50530-12-6) → 10-bromodecanoic acid methyl ester (26825-94-5)

Guidance literature:

With toluene-4-sulfonic acid; for 24h; Ambient temperature;

DOI:10.1021/jo00017a027

Reference yield:

10-bromodecanoic acid (50530-12-6) + sulfuric acid (7664-93-9) → 10-bromodecanoic acid methyl ester (26825-94-5)

Guidance literature:

In methanol;

upstream raw materials:

methanol

10-bromodecanoic acid

diazomethane

1,10-Decanediol

Downstream raw materials:

10-bromodecanoic acid

10-(2-Nitro-phenylselanyl)-decanoic acid methyl ester

10-(3,4,5-Triphenyl-pyrazol-1-yl)-decanoic acid methyl ester

methyl 9-decenoate