Prop-2-ynyl 2-cyanoacrylate

Base Information

Chemical Name:Prop-2-ynyl 2-cyanoacrylate
CAS No.:44898-13-7
Molecular Formula:C7H5NO2
Molecular Weight:135.1201
Hs Code.:
European Community (EC) Number:256-168-2
DSSTox Substance ID:DTXSID60196332
Nikkaji Number:J319.933I
Wikidata:Q83069396
Mol file:44898-13-7.mol

Synonyms:Prop-2-ynyl 2-cyanoacrylate;44898-13-7;prop-2-ynyl 2-cyanoprop-2-enoate;EINECS 256-168-2;propargyl 2-cyano-acrylate;SCHEMBL601824;DTXSID60196332;2-Cyanoacrylic acid propargyl ester;A936987

Suppliers and Price of Prop-2-ynyl 2-cyanoacrylate

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 Prop-2-ynyl 2-cyanoacrylate

Chemical Property:

Vapor Pressure:0.0932mmHg at 25°C
Boiling Point:224°Cat760mmHg
Flash Point:95.6°C
PSA：50.09000
Density:1.129g/cm³
LogP:0.24258
XLogP3:0.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:135.032028402
Heavy Atom Count:10
Complexity:247

Purity/Quality:: 98%Min ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C=C(C#N)C(=O)OCC#C

Technology Process of Prop-2-ynyl 2-cyanoacrylate

There total 3 articles about Prop-2-ynyl 2-cyanoacrylate 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: 73.0%

: 30764-61-5
cyanoacetic acid propargyl ester

: 44898-13-7
propargyl 2-cyanoacrylate

Guidance literature:: With hydroquinone; at 20 ℃; for 0.0833333h; Neat (no solvent);

Reference yield:

: 108-31-6
maleic anhydride

: 1442690-41-6
propargylcyanoacrylate anthracene adduct

: 103515-22-6
dibenzobarallene

: 44898-13-7
propargyl 2-cyanoacrylate

Guidance literature:: With phosphorus pentoxide; hydroquinone; In 5,5-dimethyl-1,3-cyclohexadiene; for 56h; Inert atmosphere; Reflux;
DOI:10.1021/ma400837h

Reference yield:

: 50-00-0,30525-89-4,61233-19-0
formaldehyd

: 30764-61-5
cyanoacetic acid propargyl ester

: 44898-13-7
propargyl 2-cyanoacrylate

Guidance literature:: With piperidine; phosphorus pentoxide; toluene-4-sulfonic acid; hydroquinone; Yield given. Multistep reaction; 1.) i-PrOH, 60 deg C, 2.) 170-190 deg C;
DOI:10.1007/BF00699831