[2-[[2-Cyano-3-[4-[ethylbenzylamino]phenyl]-1-oxoallyl]oxy]ethyl]trimethylammonium chloride

Base Information

• Chemical Name: [2-[[2-Cyano-3-[4-[ethylbenzylamino]phenyl]-1-oxoallyl]oxy]ethyl]trimethylammonium chloride
• CAS No.: 71550-24-8
• Molecular Formula: C24H30 N3 O2 . Cl
• Molecular Weight: 427.9669
• European Community (EC) Number: 275-604-2
• Mol file: 71550-24-8.mol

Synonyms:EINECS 275-604-2;[2-[[2-Cyano-3-[4-[ethylbenzylamino]phenyl]-1-oxoallyl]oxy]ethyl]trimethylammonium chloride;(2-((2-Cyano-3-(4-(ethylbenzylamino)phenyl)-1-oxoallyl)oxy)ethyl)trimethylammonium chloride;Ethanaminium, 2-((2-cyano-3-(4-(ethyl(phenylmethyl)amino)phenyl)-1-oxo-2-propen-1-yl)oxy)-N,N,N-trimethyl-, chloride (1:1);Ethanaminium, 2-((2-cyano-3-(4-(ethyl(phenylmethyl)amino)phenyl)-1-oxo-2-propenyl)oxy)-N,N,N-trimethyl-, chloride;Ethaneaminium, 2-((2-cyano-3-(4-(ethyl(phenylmethyl)amino)phenyl)-1-oxo-2-propenyl)oxy)-N,N,N-trimethyl-, chloride;Ethanaminium, 2-[[2-cyano-3-[4-[ethyl(phenylmethyl)amino]phenyl]-1-oxo-2-propenyl]oxy]-N,N,N-trimethyl-, chloride;C24H30N3O2.Cl;C24-H30-N3-O2.Cl;W-111451;Ethanaminium, 2-[[2-cyano-3-[4-[ethyl(phenylmethyl) amino]phenyl]-1-oxo-2-propenyl]oxy]-N ,N,N-trimethyl-, chloride

Chemical Property of [2-[[2-Cyano-3-[4-[ethylbenzylamino]phenyl]-1-oxoallyl]oxy]ethyl]trimethylammonium chloride

Chemical Property:

• Vapor Pressure: 0Pa at 25℃
• PSA: 53.33000
• Density: 1.104[at 20℃]
• LogP: 0.87348
• Water Solubility.: 1000g/L at 20℃
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 10
• Exact Mass: 427.2026549
• Heavy Atom Count: 30
• Complexity: 585

Purity/Quality:

99.9% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C=C(C#N)C(=O)OCC[N+](C)(C)C.[Cl-]
• Isomeric SMILES: CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)/C=C(\C#N)/C(=O)OCC[N+](C)(C)C.[Cl-]