ChemSpider 2D Image | N-(4-Chloro-2-methylphenyl)-N'-ethyl-6-[4-(4-nitrophenyl)-1-piperazinyl]-1,3,5-triazine-2,4-diamine | C22H25ClN8O2

N-(4-Chloro-2-methylphenyl)-N'-ethyl-6-[4-(4-nitrophenyl)-1-piperazinyl]-1,3,5-triazine-2,4-diamine

  • Molecular FormulaC22H25ClN8O2
  • Average mass468.939 Da
  • Monoisotopic mass468.178894 Da
  • ChemSpider ID124560477

More details:

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

1,3,5-Triazine-2,4-diamine, N2-(4-chloro-2-methylphenyl)-N4-ethyl-6-[4-(4-nitrophenyl)-1-piperazinyl]- [ACD/Index Name]
N-(4-Chlor-2-methylphenyl)-N'-ethyl-6-[4-(4-nitrophenyl)-1-piperazinyl]-1,3,5-triazin-2,4-diamin [German] [ACD/IUPAC Name]
N-(4-Chloro-2-methylphenyl)-N'-ethyl-6-[4-(4-nitrophenyl)-1-piperazinyl]-1,3,5-triazine-2,4-diamine [ACD/IUPAC Name]
N-(4-Chloro-2-méthylphényl)-N'-éthyl-6-[4-(4-nitrophényl)-1-pipérazinyl]-1,3,5-triazine-2,4-diamine [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 694.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.7±3.0 kJ/mol
Flash Point: 373.8±34.3 °C
Index of Refraction: 1.684
Molar Refractivity: 128.6±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.55
ACD/LogD (pH 5.5): 3.39
ACD/BCF (pH 5.5): 147.77
ACD/KOC (pH 5.5): 772.87
ACD/LogD (pH 7.4): 4.09
ACD/BCF (pH 7.4): 746.17
ACD/KOC (pH 7.4): 3902.51
Polar Surface Area: 115 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 72.1±3.0 dyne/cm
Molar Volume: 338.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement