Dimethyl pentylpropanedioate

Base Information

Chemical Name:Dimethyl pentylpropanedioate
CAS No.:39520-21-3
Molecular Formula:C10H18O4
Molecular Weight:202.251
Hs Code.:2917190090
DSSTox Substance ID:DTXSID90500165
Nikkaji Number:J127.742A
Wikidata:Q82351568
Mol file:39520-21-3.mol

Synonyms:Dimethyl pentylpropanedioate;39520-21-3;DIMETHYL PENTYLMALONATE;dimethyl 2-pentylpropanedioate;dimethyl 2-pentylmalonate;DIMETHYLPENTYLMALONATE;SCHEMBL2941499;DTXSID90500165;2-pentyl-propanedioic acid dimethyl ester

Suppliers and Price of Dimethyl pentylpropanedioate

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

American Custom Chemicals Corporation
DIMETHYL PENTYLMALONATE 95.00%
5MG
$ 502.14

Total 4 raw suppliers

Chemical Property of Dimethyl pentylpropanedioate

Chemical Property:

Vapor Pressure:0.0528mmHg at 25°C
Boiling Point:234.5°C at 760 mmHg
Flash Point:103.8°C
PSA：52.60000
Density:1.006g/cm³
LogP:1.52890
XLogP3:2.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:202.12050905
Heavy Atom Count:14
Complexity:173

Purity/Quality:

99% ^*data from raw suppliers

DIMETHYL PENTYLMALONATE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCC(C(=O)OC)C(=O)OC

Technology Process of Dimethyl pentylpropanedioate

There total 8 articles about Dimethyl pentylpropanedioate 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: 92.0%

: 546-67-8
lead(IV) tetraacetate

: 86593-94-4
(E/Z)-1-methoxy-1-trimethylsilyloxy-1-heptene

: 39520-21-3
Pentylmalonsaeure-dimethylester

Guidance literature:: With triethylamine hydrofluoride; In dichloromethane; 1.) 30 min, RT, 2.) 5-10 h, RT;
DOI:10.1021/jo00173a031

Reference yield:

: 110-53-2
1-Bromopentane

: 108-59-8
malonic acid dimethyl ester

: 39520-21-3
Pentylmalonsaeure-dimethylester

Guidance literature:: With methanol; sodium;
DOI:10.1021/ja00776a032

Reference yield:

: 106-73-0
methyl heptanoate

: 39520-21-3
Pentylmalonsaeure-dimethylester

Guidance literature:: Multi-step reaction with 2 steps

1: diisopropylamine, n-butyllithium / 1.) THF, -78 deg C, 10 min, 2.) 3 h, warm. to RT

2: 92 percent / 2.) triethylammonium fluoride / CH₂Cl₂ / 1.) 30 min, RT, 2.) 5-10 h, RT

With n-butyllithium; triethylamine hydrofluoride; diisopropylamine; In dichloromethane;
DOI:10.1021/jo00173a031