Methyl 8-methyldecanoate

Base Information

Chemical Name:Methyl 8-methyldecanoate
CAS No.:5129-64-6
Molecular Formula:C12H24O2
Molecular Weight:200.321
Hs Code.:
DSSTox Substance ID:DTXSID10509478
Nikkaji Number:J140.904B
Mol file:5129-64-6.mol

Synonyms:Methyl 8-methyldecanoate;5129-64-6;methyl-8-methyldecanoate;Methyl 8-methyl-decanoate;SCHEMBL16489317;DTXSID10509478;IGCINGTWMUZAIE-UHFFFAOYSA-N

Suppliers and Price of Methyl 8-methyldecanoate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 4 raw suppliers

Chemical Property of Methyl 8-methyldecanoate

Chemical Property:

XLogP3:4.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:9
Exact Mass:200.177630004
Heavy Atom Count:14
Complexity:143

Purity/Quality:: 95% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(C)CCCCCCC(=O)OC

Technology Process of Methyl 8-methyldecanoate

There total 11 articles about Methyl 8-methyldecanoate 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: 52.0%

: 54089-01-9
5-methyl-1-bromoheptane

: 292638-85-8,9003-21-8,96-33-3
acrylic acid methyl ester

: 5129-64-6
8-methyldecanoic acid methyl ester

Guidance literature:: 5-methyl-1-bromoheptane; With magnesium;

acrylic acid methyl ester; With dmap; chloro-trimethyl-silane; copper(I) bromide dimethylsulfide complex; In tetrahydrofuran; at -78 ℃; for 3.5h;
DOI:10.3762/bjoc.7.200

Reference yield:

: 10422-35-2,99032-67-4,534-00-9,5973-11-5
1-bromo-2-methyl-butane

: 5129-64-6
8-methyldecanoic acid methyl ester

Guidance literature:: Multi-step reaction with 4 steps

1.1: magnesium

1.2: 3.5 h / -78 °C

2.1: lithium aluminium tetrahydride / diethyl ether / 12 h / Reflux

3.1: bromine; triphenylphosphine / dichloromethane / 2 h / 0 °C

4.1: magnesium

4.2: 3.5 h / -78 °C

With lithium aluminium tetrahydride; bromine; magnesium; triphenylphosphine; In diethyl ether; dichloromethane;
DOI:10.3762/bjoc.7.200