ChemSpider 2D Image | N-(1H-Benzotriazol-1-ylmethyl)-N-(4-methoxybenzyl)-3-(2-methyl-2-propanyl)-1-phenyl-1H-pyrazol-5-amine | C28H30N6O

N-(1H-Benzotriazol-1-ylmethyl)-N-(4-methoxybenzyl)-3-(2-methyl-2-propanyl)-1-phenyl-1H-pyrazol-5-amine

  • Molecular FormulaC28H30N6O
  • Average mass466.577 Da
  • Monoisotopic mass466.248108 Da
  • ChemSpider ID30654051

More details:

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

1H-1,2,3-Benzotriazole-1-methanamine, N-[3-(1,1-dimethylethyl)-1-phenyl-1H-pyrazol-5-yl]-N-[(4-methoxyphenyl)methyl]- [ACD/Index Name]
N-(1H-Benzotriazol-1-ylmethyl)-N-(4-methoxybenzyl)-3-(2-methyl-2-propanyl)-1-phenyl-1H-pyrazol-5-amin [German] [ACD/IUPAC Name]
N-(1H-Benzotriazol-1-ylmethyl)-N-(4-methoxybenzyl)-3-(2-methyl-2-propanyl)-1-phenyl-1H-pyrazol-5-amine [ACD/IUPAC Name]
N-(1H-Benzotriazol-1-ylméthyl)-N-(4-méthoxybenzyl)-3-(2-méthyl-2-propanyl)-1-phényl-1H-pyrazol-5-amine [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 659.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.1±3.0 kJ/mol
Flash Point: 352.9±31.5 °C
Index of Refraction: 1.633
Molar Refractivity: 141.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 6.94
ACD/LogD (pH 5.5): 5.61
ACD/BCF (pH 5.5): 10811.80
ACD/KOC (pH 5.5): 26784.12
ACD/LogD (pH 7.4): 5.62
ACD/BCF (pH 7.4): 10913.96
ACD/KOC (pH 7.4): 27037.22
Polar Surface Area: 61 Å2
Polarizability: 55.9±0.5 10-24cm3
Surface Tension: 45.7±7.0 dyne/cm
Molar Volume: 395.1±7.0 cm3

Click to predict properties on the Chemicalize site


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