Ethyl 2-cyano-3,5-dimethylhexanoate

Base Information

Chemical Name:Ethyl 2-cyano-3,5-dimethylhexanoate
CAS No.:53246-79-0
Molecular Formula:C11H19NO2
Molecular Weight:197.2741
Hs Code.:
NSC Number:124629
DSSTox Substance ID:DTXSID50298612

Synonyms:53246-79-0;ethyl 2-cyano-3,5-dimethylhexanoate;NSC124629;DTXSID50298612;AKOS006278281;NSC-124629

Suppliers and Price of Ethyl 2-cyano-3,5-dimethylhexanoate

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 Ethyl 2-cyano-3,5-dimethylhexanoate

Chemical Property:

Vapor Pressure:0.0782mmHg at 25°C
Boiling Point:227.3°Cat760mmHg
Flash Point:97.4°C
Density:0.947g/cm³
XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:197.141578849
Heavy Atom Count:14
Complexity:227

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C(C#N)C(C)CC(C)C

Technology Process of Ethyl 2-cyano-3,5-dimethylhexanoate

There total 2 articles about Ethyl 2-cyano-3,5-dimethylhexanoate 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:

: 108-10-1
4-methyl-2-pentanone

: 105-56-6
ethyl 2-cyanoacetate

: 53246-79-0
ethyl 2-cyano-3,5-dimethylhex-2-enoate

Guidance literature:: With ammonium acetate; ethanol; acetic acid; under 735.5 - 1471.02 Torr; Hydrogenation_.Reagens 4: Palladiumkohle;

Reference yield:

: 30310-22-6
2-bromo-4-methylpentane

: 105-56-6
ethyl 2-cyanoacetate

: 53246-79-0
ethyl 2-cyano-3,5-dimethylhex-2-enoate

Guidance literature:: With ethanol; sodium ethanolate;
DOI:10.1007/BF02504921

Reference yield:

: 53246-79-0
ethyl 2-cyano-3,5-dimethylhex-2-enoate

: 2801-54-9
DL-δ,δ-Dimethyl-isoleucin

Guidance literature:: Multi-step reaction with 2 steps

1: hydrazine hydrate

2: aqueous HCl; aqueous NaNO₂ / Erwaermen des Reaktionsprodukts mit Aethanol und Erhitzen des danach erhaltenen Reaktionsprodukts mit wss.HCl

With hydrogenchloride; hydrazine hydrate; sodium nitrite;
DOI:10.1007/BF02504921