Methyl 3-methylpentanoate

Base Information

Chemical Name:Methyl 3-methylpentanoate
CAS No.:2177-78-8
Molecular Formula:C7H14 O2
Molecular Weight:130.187
Hs Code.:2915900090
European Community (EC) Number:626-981-0
DSSTox Substance ID:DTXSID70334182
Nikkaji Number:J109.249I
Mol file:2177-78-8.mol

Synonyms:Methyl 3-methylpentanoate;2177-78-8;Methyl 3-methylvalerate;METHYL3-METHYLPENTANOATE;Valeric acid, 3-methyl-, methyl ester;Pentanoic acid, 3-methyl-, methyl ester;Pentanoic acid,3-methyl-,methyl ester;methyl-3-methyl pentanoate;Methyl .beta.-methylvalerate;SCHEMBL5711131;DTXSID70334182;3-Methylvaleric acid methyl ester;3-Methylvaleric acid, methyl ester;Methyl 3-methylvalerate, >=97.0%;FT-0710427;J-014282;2,2-[1,4-PHENYLENEBIS(METHYLENE)]BIS-1H-BENZOIMIDAZOLE

Suppliers and Price of Methyl 3-methylpentanoate

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

Sigma-Aldrich
Methyl 3-methylvalerate ≥97.0%
10ml
$ 151.00

American Custom Chemicals Corporation
METHYL 3-METHYLPENTANOATE 95.00%
10ML
$ 1177.52

Total 8 raw suppliers

Chemical Property of Methyl 3-methylpentanoate

Chemical Property:

Vapor Pressure:7.85mmHg at 25°C
Refractive Index:n20/D 1.405
Boiling Point:135.1°C at 760 mmHg
Flash Point:41 °C
PSA：26.30000
Density:0.88 g/mL at 20 °C(lit.)
LogP:1.59560
XLogP3:2.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:130.099379685
Heavy Atom Count:9
Complexity:88.9

Purity/Quality:

99% ^*data from raw suppliers

Methyl 3-methylvalerate ≥97.0% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:
Statements: 10
Safety Statements: 23-24/25

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of Methyl 3-methylpentanoate

There total 9 articles about Methyl 3-methylpentanoate 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: 85.0%

: 390410-67-0
methyl 4-fluoro-3-methyl-2-pentenoate

: 2177-78-8
3-methylvaleric acid methyl ester

: 77163-94-1
4-Fluoro-3-methyl-pentanoic acid methyl ester

Guidance literature:: With hydrogen; calcium carbonate; rhodium on carbon nanotubes; under 3040 - 3800 Torr;
DOI:10.1016/S0022-1139(00)82317-9

Reference yield:

: 67-56-1
methanol

: 589-35-5,20281-83-8
3-methyl-1-pentanol

: 52450-70-1
3-methylpentyl 3-methylpentanoate

: 2177-78-8
3-methylvaleric acid methyl ester

Guidance literature:: With hydrogen bromide; dihydrogen peroxide; In water; at 65 - 70 ℃;
DOI:10.1007/s11172-015-1236-4

Reference yield:

: 623-43-8
crotonic acid methyl ester

: 925-90-6
ethylmagnesium bromide

: 2177-78-8
3-methylvaleric acid methyl ester

Guidance literature:: With cuprous 2-methoxythiophenoxide; Yield given. Multistep reaction; 1.) ether, -25 deg C, 20 min; 2.) ether, -70 deg C, 60 min, -40 deg C, 60 min, warmed to 0 deg C;
DOI:10.1016/S0040-4039(00)84727-9