2,3,5,6,7,8-Hexahydro-5-((dimethylamino)methylene)-3-oxo-4-isoquinolinecarbonitrile

Base Information

Chemical Name:2,3,5,6,7,8-Hexahydro-5-((dimethylamino)methylene)-3-oxo-4-isoquinolinecarbonitrile
CAS No.:128767-22-6
Molecular Formula:C₁₃H₁₅N₃O
Molecular Weight:229.282
Hs Code.:
Wikidata:Q76279210
Mol file:128767-22-6.mol

Synonyms:BRN 4189765;128767-22-6;2,3,5,6,7,8-Hexahydro-5-((dimethylamino)methylene)-3-oxo-4-isoquinolinecarbonitrile;4-Isoquinolinecarbonitrile, 2,3,5,6,7,8-hexahydro-5-((dimethylamino)methylene)-3-oxo-;5-((Dimethylamino)methylene)-3-oxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carbonitrile;LS-85377

Suppliers and Price of 2,3,5,6,7,8-Hexahydro-5-((dimethylamino)methylene)-3-oxo-4-isoquinolinecarbonitrile

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 2,3,5,6,7,8-Hexahydro-5-((dimethylamino)methylene)-3-oxo-4-isoquinolinecarbonitrile

Chemical Property:

Vapor Pressure:4.35E-08mmHg at 25°C
Boiling Point:444.2°Cat760mmHg
Flash Point:222.5°C
PSA：60.15000
Density:1.2g/cm³
LogP:1.89768
XLogP3:0.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:229.121512110
Heavy Atom Count:17
Complexity:500

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN(C)C=C1CCCC2=CNC(=O)C(=C21)C#N
Isomeric SMILES:CN(C)/C=C/1\CCCC2=CNC(=O)C(=C21)C#N

Technology Process of 2,3,5,6,7,8-Hexahydro-5-((dimethylamino)methylene)-3-oxo-4-isoquinolinecarbonitrile

There total 1 articles about 2,3,5,6,7,8-Hexahydro-5-((dimethylamino)methylene)-3-oxo-4-isoquinolinecarbonitrile 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: 9.0%