ChemSpider 2D Image | 4-Chloro-N-[(Z)-phenyl(1,3,5-triazatricyclo[3.3.1.1~3,7~]dec-7-yl)methylene]aniline | C20H21ClN4

4-Chloro-N-[(Z)-phenyl(1,3,5-triazatricyclo[3.3.1.13,7]dec-7-yl)methylene]aniline

  • Molecular FormulaC20H21ClN4
  • Average mass352.861 Da
  • Monoisotopic mass352.145477 Da
  • ChemSpider ID22939133

  • Double-bond stereo - Double-bond stereo

More details:

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

(Z)-N-(4-Chlorophenyl)-1-phenyl-1-(1,3,5-triazatricyclo[3.3.1.13,7]dec-7-yl)methanimine [ACD/IUPAC Name]
(Z)-N-(4-Chlorophényl)-1-phényl-1-(1,3,5-triazatricyclo[3.3.1.13,7]déc-7-yl)méthanimine [French] [ACD/IUPAC Name]
(Z)-N-(4-Chlorphenyl)-1-phenyl-1-(1,3,5-triazatricyclo[3.3.1.13,7]dec-7-yl)methanimin [German] [ACD/IUPAC Name]
4-Chloro-N-[(Z)-phenyl(1,3,5-triazatricyclo[3.3.1.13,7]dec-7-yl)methylene]aniline
Benzenamine, 4-chloro-N-[(1Z)-phenyl-1,3,5-triazatricyclo[3.3.1.13,7]dec-7-ylmethylene]- [ACD/Index Name]
4-chloro-N-[(Z)-phenyl(1,3,5-triazatricyclo[3.3.1.13,7]dec-7-yl)methylidene]aniline
7-[(1Z)-2-(4-chlorophenyl)-1-phenyl-2-azavinyl]-1,3,5-triazatricyclo[3.3.1.1<3,7>]decane

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

Density: 1.3±0.1 g/cm3
Boiling Point: 467.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.9±3.0 kJ/mol
Flash Point: 236.3±28.7 °C
Index of Refraction: 1.701
Molar Refractivity: 102.0±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.26
ACD/LogD (pH 5.5): 4.57
ACD/BCF (pH 5.5): 1682.56
ACD/KOC (pH 5.5): 6738.02
ACD/LogD (pH 7.4): 4.65
ACD/BCF (pH 7.4): 2009.34
ACD/KOC (pH 7.4): 8046.68
Polar Surface Area: 22 Å2
Polarizability: 40.4±0.5 10-24cm3
Surface Tension: 55.1±7.0 dyne/cm
Molar Volume: 263.7±7.0 cm3

Click to predict properties on the Chemicalize site


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