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Search term: OFELXUWNGBXCPK-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 4-(2-{[(2-Amino-7-quinolinyl)methyl]amino}ethyl)-2-methylbenzonitrile | C20H20N4

4-(2-{[(2-Amino-7-quinolinyl)methyl]amino}ethyl)-2-methylbenzonitrile

  • Molecular FormulaC20H20N4
  • Average mass316.400 Da
  • Monoisotopic mass316.168793 Da
  • ChemSpider ID61716400

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4-(2-{[(2-Amino-7-chinolinyl)methyl]amino}ethyl)-2-methylbenzonitril [German] [ACD/IUPAC Name]
4-(2-{[(2-Amino-7-quinoléinyl)méthyl]amino}éthyl)-2-méthylbenzonitrile [French] [ACD/IUPAC Name]
4-(2-{[(2-Amino-7-quinolinyl)methyl]amino}ethyl)-2-methylbenzonitrile [ACD/IUPAC Name]
Benzonitrile, 4-[2-[[(2-amino-7-quinolinyl)methyl]amino]ethyl]-2-methyl- [ACD/Index Name]
4-(2-{[(2-Aminoquinolin-7-Yl)methyl]amino}ethyl)-2-Methylbenzonitrile
9P7

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 552.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.3±3.0 kJ/mol
Flash Point: 288.0±30.1 °C
Index of Refraction: 1.664
Molar Refractivity: 97.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.99
ACD/LogD (pH 5.5): 0.77
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.65
ACD/LogD (pH 7.4): 2.73
ACD/BCF (pH 7.4): 38.94
ACD/KOC (pH 7.4): 241.00
Polar Surface Area: 75 Å2
Polarizability: 38.5±0.5 10-24cm3
Surface Tension: 63.6±5.0 dyne/cm
Molar Volume: 262.1±5.0 cm3

Click to predict properties on the Chemicalize site


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