Ethyl 2-propylpent-4-enoate

Base Information

Chemical Name:Ethyl 2-propylpent-4-enoate
CAS No.:96107-26-5
Molecular Formula:C₁₀H₁₈O₂
Molecular Weight:170.252
Hs Code.:
DSSTox Substance ID:DTXSID30544861
Mol file:96107-26-5.mol

Synonyms:Ethyl 2-propylpent-4-enoate;96107-26-5;Ethyl 2-Propyl-4-pentenoate;4-Pentenoic acid, 2-propyl-, ethyl ester;2-Propyl-4-pentenoic Acid Ethyl Ester;starbld0002457;DTXSID30544861

Suppliers and Price of Ethyl 2-propylpent-4-enoate

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

Usbiological
Ethyl 2-Propyl-4-pentenoate
250mg
$ 460.00

TRC
Ethyl2-Propyl-4-pentenoate
250mg
$ 150.00

TRC
Ethyl2-Propyl-4-pentenoate
2.5g
$ 1190.00

Medical Isotopes, Inc.
Ethyl2-Propyl-4-pentenoate
250 mg
$ 650.00

Total 3 raw suppliers

Chemical Property of Ethyl 2-propylpent-4-enoate

Chemical Property:

PSA：26.30000
LogP:2.54190
Storage Temp.:-20°C Freezer
Solubility.:Chloroform (Slightly), Methanol (Slightly)
XLogP3:3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:170.130679813
Heavy Atom Count:12
Complexity:141

Purity/Quality:: Ethyl 2-Propyl-4-pentenoate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCC(CC=C)C(=O)OCC
Uses Ethyl 2-Propyl-4-pentenoate is an unsaturated metabolites of valproic acid (V094750), an anticonvulsant agent that also acts as a mood stabilizer for the treatment of bipolar disorder.

Technology Process of Ethyl 2-propylpent-4-enoate

There total 7 articles about Ethyl 2-propylpent-4-enoate 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: 88.0%

: 2-(ethoxycarbonyl)-2-propyl-4-pentenoic acid

: 96107-26-5
ethyl 2-n-propyl-4-pentenoate

Guidance literature:: With 1H-imidazole; In neat (no solvent); at 117 ℃; for 0.0666667h; Microwave irradiation;
DOI:10.1016/j.tet.2015.09.012

Reference yield:

: 75-03-6
ethyl iodide

: (R)-2-propyl-pent-4-enoic acid

: 96107-26-5
ethyl (R)-2-allylvalerate

Guidance literature:: With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 5h;

Reference yield:

: 143868-89-7
3-(1-oxopentyl)-4(S)-(phenylmethyl)-2-oxazolidinone

: 96107-26-5
ethyl (R)-2-allylvalerate

Guidance literature:: Multi-step reaction with 3 steps

1.1: sodium hexamethyldisilazane / tetrahydrofuran / 1 h / -78 °C / Inert atmosphere

1.2: 5 h / -78 °C

2.1: dihydrogen peroxide / tetrahydrofuran; water / 0.17 h / 0 °C / Inert atmosphere

2.2: 2 h / 0 °C

3.1: potassium carbonate / N,N-dimethyl-formamide / 5 h / 20 °C

With dihydrogen peroxide; sodium hexamethyldisilazane; potassium carbonate; In tetrahydrofuran; water; N,N-dimethyl-formamide;