METHYL 6-METHYLOCTANOATE

Base Information

• Chemical Name: METHYL 6-METHYLOCTANOATE
• CAS No.: 5129-62-4
• Molecular Formula: C10H20O2
• Molecular Weight: 172.268
• Hs Code.: 2915900090
• Mol file: 5129-62-4.mol

Synonyms:METHYL 6-METHYLOCTANOATE

Chemical Property of METHYL 6-METHYLOCTANOATE

Chemical Property:

• Boiling Point: 196℃
• Flash Point: 71℃
• PSA: 26.30000
• Density: 0.872
• LogP: 2.76590

Purity/Quality:

99% ，98% ^*data from raw suppliers

METHYL 6-METHYLOCTANOATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of METHYL 6-METHYLOCTANOATE

There total 3 articles about METHYL 6-METHYLOCTANOATE 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: 65.0%

3-methylpentyl bromide (51116-73-5) + acrylic acid methyl ester (292638-85-8,9003-21-8,96-33-3) → methyl 6-methyloctanoate (5129-62-4)

Guidance literature:

3-methylpentyl bromide; 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:

3-methyl-1-pentanol (589-35-5,20281-83-8) → methyl 6-methyloctanoate (5129-62-4)

Guidance literature:

Multi-step reaction with 2 steps

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

2.1: magnesium

2.2: 3.5 h / -78 °C

With bromine; magnesium; triphenylphosphine; In dichloromethane;

DOI:10.3762/bjoc.7.200

Reference yield:

→ methyl 6-methyloctanoate (5129-62-4)

Guidance literature:

aus d. Trien-aminoester (9);

DOI:10.1016/S0040-4039(01)82397-2

upstream raw materials:

3-methyl-1-pentanol

3-methylpentyl bromide

acrylic acid methyl ester

Downstream raw materials:

6-methyl-1-octanol

6-methyloctanal

14-methyl-hexadec-8c-enoic acid methyl ester

2,6-dimethyloctanal

Refernces