ChemSpider 2D Image | N-sec-Butyl-1-(2-chlorophenyl)-N-(~3~H_3_)methyl-3-isoquinolinecarboxamide | C21H18T3ClN2O

N-sec-Butyl-1-(2-chlorophenyl)-N-(3H3)methyl-3-isoquinolinecarboxamide

  • Molecular FormulaC21H18T3ClN2O
  • Average mass358.882 Da
  • Monoisotopic mass358.158905 Da
  • ChemSpider ID26376023

  • Non-standard isotope - Non-standard isotope

More details:

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

3-Isoquinolinecarboxamide, 1-(2-chlorophenyl)-N-(methyl-t3)-N-(1-methylpropyl)- [ACD/Index Name]
N-sec-Butyl-1-(2-chlorophényl)-N-(3H3)méthyl-3-isoquinoléinecarboxamide [French] [ACD/IUPAC Name]
N-sec-Butyl-1-(2-chlorophenyl)-N-(3H3)methyl-3-isoquinolinecarboxamide [ACD/IUPAC Name]
N-sec-Butyl-1-(2-chlorphenyl)-N-(3H3)methyl-3-isochinolincarboxamid [German] [ACD/IUPAC Name]

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

Density:
Boiling Point: 511.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.3±3.0 kJ/mol
Flash Point: 263.3±28.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.58
ACD/LogD (pH 5.5): 4.94
ACD/BCF (pH 5.5): 3322.13
ACD/KOC (pH 5.5): 11539.89
ACD/LogD (pH 7.4): 4.94
ACD/BCF (pH 7.4): 3322.72
ACD/KOC (pH 7.4): 11541.96
Polar Surface Area: 33 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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