ChemSpider 2D Image | N-{(2,4-Dichlorophenyl)[1-(2-methylphenyl)-5-tetrazolidinyl]methyl}-2-(2-methyl-1H-indol-3-yl)ethanamine | C26H28Cl2N6

N-{(2,4-Dichlorophenyl)[1-(2-methylphenyl)-5-tetrazolidinyl]methyl}-2-(2-methyl-1H-indol-3-yl)ethanamine

  • Molecular FormulaC26H28Cl2N6
  • Average mass495.447 Da
  • Monoisotopic mass494.175262 Da
  • ChemSpider ID110008403

More details:

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

1H-Indole-3-ethanamine, N-[(2,4-dichlorophenyl)[1-(2-methylphenyl)-5-tetrazolidinyl]methyl]-2-methyl- [ACD/Index Name]
N-{(2,4-Dichlorophenyl)[1-(2-methylphenyl)-5-tetrazolidinyl]methyl}-2-(2-methyl-1H-indol-3-yl)ethanamine [ACD/IUPAC Name]
N-{(2,4-Dichlorophényl)[1-(2-méthylphényl)-5-tétrazolidinyl]méthyl}-2-(2-méthyl-1H-indol-3-yl)éthanamine [French] [ACD/IUPAC Name]
N-{(2,4-Dichlorphenyl)[1-(2-methylphenyl)-5-tetrazolidinyl]methyl}-2-(2-methyl-1H-indol-3-yl)ethanamin [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: 645.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.2±3.0 kJ/mol
Flash Point: 344.1±34.3 °C
Index of Refraction: 1.658
Molar Refractivity: 140.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 6.80
ACD/LogD (pH 5.5): 4.28
ACD/BCF (pH 5.5): 457.41
ACD/KOC (pH 5.5): 1035.85
ACD/LogD (pH 7.4): 5.67
ACD/BCF (pH 7.4): 11206.15
ACD/KOC (pH 7.4): 25377.73
Polar Surface Area: 67 Å2
Polarizability: 55.9±0.5 10-24cm3
Surface Tension: 53.5±3.0 dyne/cm
Molar Volume: 382.5±3.0 cm3

Click to predict properties on the Chemicalize site


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