Ethyl 2,4-dicyano-2-methylbutanoate

Base Information

Chemical Name:Ethyl 2,4-dicyano-2-methylbutanoate
CAS No.:30378-23-5
Molecular Formula:C9H12N2O2
Molecular Weight:180.206
Hs Code.:
DSSTox Substance ID:DTXSID70561734
Nikkaji Number:J305.908A
Mol file:30378-23-5.mol

Synonyms:Ethyl 2,4-dicyano-2-methylbutanoate;30378-23-5;SCHEMBL11566033;DTXSID70561734

Suppliers and Price of Ethyl 2,4-dicyano-2-methylbutanoate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Total 0 raw suppliers

Chemical Property of Ethyl 2,4-dicyano-2-methylbutanoate

Chemical Property:

XLogP3:0.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:180.089877630
Heavy Atom Count:13
Complexity:281

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

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

Technology Process of Ethyl 2,4-dicyano-2-methylbutanoate

There total 3 articles about Ethyl 2,4-dicyano-2-methylbutanoate 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: 59.0%

: 64-17-5
ethanol

: 201230-82-2
carbon monoxide

: 107-13-1,25014-41-9
acrylonitrile

: 122-57-6
1-Phenylbut-1-en-3-one

: 10137-67-4
ethyl 3-cyanopropionate

: 30378-23-5
2,4-dicyano-2-methylbutanoic acid ethyl ester

: 115906-97-3
2-cyano-5-oxo-3-phenyl-2-methylhexanoic acid ethyl ester

: 1572-99-2
ethyl 2-cyanopropionate

Guidance literature:: With pyridine; dicobalt octacarbonyl; at 110 ℃; under 75005.9 Torr; Further byproducts given;
DOI:10.1021/jo00295a049

Reference yield: 44.0%

: 64-17-5
ethanol

: 201230-82-2
carbon monoxide

: 107-13-1,25014-41-9
acrylonitrile

: 140-88-5,9003-32-1
ethyl acrylate

: 10137-67-4
ethyl 3-cyanopropionate

: 30378-23-5
2,4-dicyano-2-methylbutanoic acid ethyl ester

: 91341-03-6
2-cyano-2-methyl-1,5-pentanedioic acid bis(ethyl ester)

: 1572-99-2
ethyl 2-cyanopropionate

Guidance literature:: With pyridine; dicobalt octacarbonyl; at 110 ℃; under 75005.9 Torr; Further byproducts given;
DOI:10.1021/jo00295a049

Reference yield:

: 64-17-5
ethanol

: 201230-82-2
carbon monoxide

: 107-13-1,25014-41-9
acrylonitrile

: 10137-67-4
ethyl 3-cyanopropionate

: 30378-23-5
2,4-dicyano-2-methylbutanoic acid ethyl ester

: 1572-99-2
ethyl 2-cyanopropionate

Guidance literature:: With pyridine; dicobalt octacarbonyl; In toluene; at 110 ℃; for 6h; under 75005.9 - 90007.2 Torr;
DOI:10.1021/jo00295a049