Ethyl 3-cyanopropanoate

Base Information

Chemical Name:Ethyl 3-cyanopropanoate
CAS No.:10137-67-4
Molecular Formula:C6H9 N O2
Molecular Weight:127.143
Hs Code.:2926909090
European Community (EC) Number:849-369-7
NSC Number:94973
UNII:Q745927X6R
DSSTox Substance ID:DTXSID10143876
Nikkaji Number:J51.081E
Wikidata:Q27287074
Mol file:10137-67-4.mol

Synonyms:Ethyl 3-cyanopropanoate;10137-67-4;Propanoic acid, 3-cyano-, ethyl ester;3-Cyanopropionic acid, ethyl ester;ethyl 3-cyanopropionate;3-Cyanopropanoic acid ethyl ester;Propionic acid, 3-cyano-, ethyl ester;NSC 94973;BRN 1756022;UNII-Q745927X6R;MFCD01695650;NSC-94973;Q745927X6R;Ethyl3-cyanopropanoate;Ethyl 3-Cyano Propanoate;Ethyl 3-cyanopropanoate #;WLN: NC2VO2;SCHEMBL533711;DTXSID10143876;NSC94973;AKOS015959723;AS-41886;LS-124607;CS-0094471;EN300-748832;A897185;Q27287074

Suppliers and Price of Ethyl 3-cyanopropanoate

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

TRC
Ethyl3-Cyanopropanoate
250mg
$ 210.00

Matrix Scientific
Ethyl 3-cyanopropanoate
500mg
$ 130.00

Matrix Scientific
Ethyl 3-cyanopropanoate
1g
$ 203.00

Matrix Scientific
Ethyl 3-cyanopropanoate
5g
$ 600.00

Crysdot
Ethyl3-cyanopropanoate 97%
5g
$ 468.00

ChemScene
Ethyl3-cyanopropanoate ≥97.0%
250mg
$ 97.00

ChemScene
Ethyl3-cyanopropanoate ≥97.0%
100mg
$ 58.00

ChemScene
Ethyl3-cyanopropanoate ≥97.0%
1g
$ 194.00

Apolloscientific
Ethyl 3-cyanopropanoate
1g
$ 568.00

American Custom Chemicals Corporation
ETHYL 3-CYANOPROPANOATE 95.00%
5MG
$ 505.24

Total 26 raw suppliers

Chemical Property of Ethyl 3-cyanopropanoate

Chemical Property:

Vapor Pressure:0.113mmHg at 25°C
Boiling Point:220.4°C at 760 mmHg
Flash Point:93.6°C
PSA：50.09000
Density:1.021g/cm³
LogP:0.85328
Storage Temp.:2-8°C
XLogP3:0.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:127.063328530
Heavy Atom Count:9
Complexity:133

Purity/Quality:

97% ^*data from raw suppliers

Ethyl3-Cyanopropanoate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)CCC#N

Technology Process of Ethyl 3-cyanopropanoate

There total 24 articles about Ethyl 3-cyanopropanoate 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: 95.9%

: 623-71-2
ethyl 3-chloropropanoate

: 75-86-5
2-hydroxy-2-methylpropanenitrile

: 10137-67-4
ethyl 3-cyanopropionate

Guidance literature:: 2-hydroxy-2-methylpropanenitrile; With lithium hydroxide monohydrate; In tetrahydrofuran; at 50 ℃; for 1h;

ethyl 3-chloropropanoate; In tetrahydrofuran;

Reference yield: 87.0%

: 1204763-32-5
diethyl 2-cyano-2-ethoxycarbonylbutanedioate

: 10137-67-4
ethyl 3-cyanopropionate

Guidance literature:: With water; sodium chloride; In dimethyl sulfoxide; at 140 ℃; for 18h;
DOI:10.2174/157018010789869361

Reference yield: 83.0%

: 42201-84-3
1-ethoxy-1-(tert-butyldimethylsilyloxy)ethene

: 107-14-2
chloroacetonitrile

: 10137-67-4
ethyl 3-cyanopropionate

Guidance literature:: 1-ethoxy-1-(tert-butyldimethylsilyloxy)ethene; chloroacetonitrile; With 2,6-dimethylpyridine; potassium 5-bromo-1H-indole-1-carbodithioate; In acetonitrile; at 25 ℃; for 24h; Schlenk technique; Inert atmosphere; Irradiation;

With trifluoroacetic acid; In chloroform; acetonitrile; Schlenk technique; Inert atmosphere;
DOI:10.1002/anie.201915814