ChemSpider 2D Image | 6-(1-Azepanyl)-N-(3,4-dichlorophenyl)-N'-(4-phenylbutyl)-1,3,5-triazine-2,4-diamine | C25H30Cl2N6

6-(1-Azepanyl)-N-(3,4-dichlorophenyl)-N'-(4-phenylbutyl)-1,3,5-triazine-2,4-diamine

  • Molecular FormulaC25H30Cl2N6
  • Average mass485.452 Da
  • Monoisotopic mass484.190887 Da
  • ChemSpider ID124480289

More details:

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

1,3,5-Triazine-2,4-diamine, N2-(3,4-dichlorophenyl)-6-(hexahydro-1H-azepin-1-yl)-N4-(4-phenylbutyl)- [ACD/Index Name]
6-(1-Azepanyl)-N-(3,4-dichlorophenyl)-N'-(4-phenylbutyl)-1,3,5-triazine-2,4-diamine [ACD/IUPAC Name]
6-(1-Azépanyl)-N-(3,4-dichlorophényl)-N'-(4-phénylbutyl)-1,3,5-triazine-2,4-diamine [French] [ACD/IUPAC Name]
6-(1-Azepanyl)-N-(3,4-dichlorphenyl)-N'-(4-phenylbutyl)-1,3,5-triazin-2,4-diamin [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 663.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.6±3.0 kJ/mol
Flash Point: 355.1±34.3 °C
Index of Refraction: 1.644
Molar Refractivity: 137.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 6.46
ACD/LogD (pH 5.5): 6.08
ACD/BCF (pH 5.5): 19778.14
ACD/KOC (pH 5.5): 32263.28
ACD/LogD (pH 7.4): 6.45
ACD/BCF (pH 7.4): 46651.87
ACD/KOC (pH 7.4): 76101.29
Polar Surface Area: 66 Å2
Polarizability: 54.4±0.5 10-24cm3
Surface Tension: 62.0±3.0 dyne/cm
Molar Volume: 378.7±3.0 cm3

Click to predict properties on the Chemicalize site


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