ChemSpider 2D Image | N-(2,4-Dichloro-5-pyrimidinyl)-2-methyl-N-(4H-1,2,4-triazol-4-yl)benzo[cd]indol-6-amine | C18H11Cl2N7

N-(2,4-Dichloro-5-pyrimidinyl)-2-methyl-N-(4H-1,2,4-triazol-4-yl)benzo[cd]indol-6-amine

  • Molecular FormulaC18H11Cl2N7
  • Average mass396.233 Da
  • Monoisotopic mass395.045288 Da
  • ChemSpider ID108655725

More details:

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

Benz[cd]indol-6-amine, N-(2,4-dichloro-5-pyrimidinyl)-2-methyl-N-4H-1,2,4-triazol-4-yl- [ACD/Index Name]
N-(2,4-Dichlor-5-pyrimidinyl)-2-methyl-N-(4H-1,2,4-triazol-4-yl)benzo[cd]indol-6-amin [German] [ACD/IUPAC Name]
N-(2,4-Dichloro-5-pyrimidinyl)-2-methyl-N-(4H-1,2,4-triazol-4-yl)benzo[cd]indol-6-amine [ACD/IUPAC Name]
N-(2,4-Dichloro-5-pyrimidinyl)-2-méthyl-N-(4H-1,2,4-triazol-4-yl)benzo[cd]indol-6-amine [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 631.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.3±3.0 kJ/mol
Flash Point: 335.5±34.3 °C
Index of Refraction: 1.813
Molar Refractivity: 105.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.71
ACD/LogD (pH 5.5): 2.15
ACD/BCF (pH 5.5): 25.23
ACD/KOC (pH 5.5): 350.67
ACD/LogD (pH 7.4): 2.15
ACD/BCF (pH 7.4): 25.29
ACD/KOC (pH 7.4): 351.40
Polar Surface Area: 72 Å2
Polarizability: 41.6±0.5 10-24cm3
Surface Tension: 66.5±7.0 dyne/cm
Molar Volume: 242.6±7.0 cm3

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