N-cyclopentyl-2-(4-ethoxyphenyl)quinoline-4-carboxamide

Base Information

• Chemical Name: N-cyclopentyl-2-(4-ethoxyphenyl)quinoline-4-carboxamide
• CAS No.: 6100-16-9
• Molecular Formula: C4H6 O6 . 4 H2 O . K . Na
• Molecular Weight: 360.4489
• European Community (EC) Number: 612-063-7
• DSSTox Substance ID: DTXSID30362325
• Wikidata: Q82145295
• Mol file: 6100-16-9.mol

Synonyms:N-cyclopentyl-2-(4-ethoxyphenyl)quinoline-4-carboxamide;6100-16-9;CBMicro_017696;Oprea1_776155;SCHEMBL12218347;DTXSID30362325;CCG-13909;STK426953;AKOS001590507;NCGC00297094-01;BIM-0017721.P001;AB01291269-01

Chemical Property of N-cyclopentyl-2-(4-ethoxyphenyl)quinoline-4-carboxamide

Chemical Property:

• Vapor Pressure: 3.35E-13mmHg at 25°C
• Refractive Index: 1.637
• Boiling Point: 574.5 °C at 760 mmHg
• Flash Point: 301.2 °C
• PSA: 157.64000
• Density: 1.2 g/cm³
• LogP: -5.04920
• Solubility.: H2O: 1 M at 20 °C, clear, colorless
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 360.183778013
• Heavy Atom Count: 27
• Complexity: 483

Purity/Quality:

99% ^*data from raw suppliers

Sodium potassium tartrate tetrahydrate ^*data from reagent suppliers

Safty Information:

• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4CCCC4