ChemSpider 2D Image | N-[2-(1-Cyclohexen-1-yl)ethyl]-N'-(3,5-dichlorophenyl)-6-(3,4-dihydro-2(1H)-isoquinolinyl)-1,3,5-triazine-2,4-diamine | C26H28Cl2N6

N-[2-(1-Cyclohexen-1-yl)ethyl]-N'-(3,5-dichlorophenyl)-6-(3,4-dihydro-2(1H)-isoquinolinyl)-1,3,5-triazine-2,4-diamine

  • Molecular FormulaC26H28Cl2N6
  • Average mass495.447 Da
  • Monoisotopic mass494.175262 Da
  • ChemSpider ID124560881

More details:

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

1,3,5-Triazine-2,4-diamine, N2-[2-(1-cyclohexen-1-yl)ethyl]-N4-(3,5-dichlorophenyl)-6-(3,4-dihydro-2(1H)-isoquinolinyl)- [ACD/Index Name]
N-[2-(1-Cyclohexén-1-yl)éthyl]-N'-(3,5-dichlorophényl)-6-(3,4-dihydro-2(1H)-isoquinoléinyl)-1,3,5-triazine-2,4-diamine [French] [ACD/IUPAC Name]
N-[2-(1-Cyclohexen-1-yl)ethyl]-N'-(3,5-dichlorophenyl)-6-(3,4-dihydro-2(1H)-isoquinolinyl)-1,3,5-triazine-2,4-diamine [ACD/IUPAC Name]
N-[2-(1-Cyclohexen-1-yl)ethyl]-N'-(3,5-dichlorphenyl)-6-(3,4-dihydro-2(1H)-isochinolinyl)-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: 677.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.4±3.0 kJ/mol
Flash Point: 363.3±34.3 °C
Index of Refraction: 1.675
Molar Refractivity: 139.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 6.80
ACD/LogD (pH 5.5): 6.68
ACD/BCF (pH 5.5): 66736.25
ACD/KOC (pH 5.5): 93290.04
ACD/LogD (pH 7.4): 6.76
ACD/BCF (pH 7.4): 81504.30
ACD/KOC (pH 7.4): 113934.16
Polar Surface Area: 66 Å2
Polarizability: 55.3±0.5 10-24cm3
Surface Tension: 65.6±3.0 dyne/cm
Molar Volume: 370.8±3.0 cm3

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