2-Cyano-3-methyl-2-hexenoic acid methyl ester

Base Information

Chemical Name:2-Cyano-3-methyl-2-hexenoic acid methyl ester
CAS No.:6666-79-1
Molecular Formula:C₉H₁₃NO₂
Molecular Weight:167.208
Hs Code.:
NSC Number:44912
DSSTox Substance ID:DTXSID40418024
Nikkaji Number:J24.728F
Wikidata:Q82228297

Synonyms:NSC44912;6666-79-1;DTXSID40418024;NSC-44912;2-Cyano-3-methyl-2-hexenoic acid methyl ester

Suppliers and Price of 2-Cyano-3-methyl-2-hexenoic acid methyl ester

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 6 raw suppliers

Chemical Property of 2-Cyano-3-methyl-2-hexenoic acid methyl ester

Chemical Property:

Vapor Pressure:0.0155mmHg at 25°C
Boiling Point:256.3°Cat760mmHg
Flash Point:113.8°C
Density:1g/cm³
XLogP3:2.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:167.094628657
Heavy Atom Count:12
Complexity:245

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCC(=C(C#N)C(=O)OC)C
Isomeric SMILES:CCC/C(=C(\C#N)/C(=O)OC)/C

Technology Process of 2-Cyano-3-methyl-2-hexenoic acid methyl ester

There total 2 articles about 2-Cyano-3-methyl-2-hexenoic acid methyl ester 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: