ChemSpider 2D Image | 4-(2-Chloro-4-nitrophenoxy)-N-{2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]benzyl}aniline | C25H21ClN4O6

4-(2-Chloro-4-nitrophenoxy)-N-{2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]benzyl}aniline

  • Molecular FormulaC25H21ClN4O6
  • Average mass508.910 Da
  • Monoisotopic mass508.114960 Da
  • ChemSpider ID21128387

More details:

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

4-(2-Chlor-4-nitrophenoxy)-N-{2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]benzyl}anilin [German] [ACD/IUPAC Name]
4-(2-Chloro-4-nitrophenoxy)-N-{2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]benzyl}aniline [ACD/IUPAC Name]
4-(2-Chloro-4-nitrophénoxy)-N-{2-[(4,6-diméthoxy-2-pyrimidinyl)oxy]benzyl}aniline [French] [ACD/IUPAC Name]
Benzenemethanamine, N-[4-(2-chloro-4-nitrophenoxy)phenyl]-2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]- [ACD/Index 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: 664.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.8±3.0 kJ/mol
Flash Point: 355.9±34.3 °C
Index of Refraction: 1.648
Molar Refractivity: 134.2±0.3 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 5.77
ACD/LogD (pH 5.5): 4.77
ACD/BCF (pH 5.5): 2486.22
ACD/KOC (pH 5.5): 9366.77
ACD/LogD (pH 7.4): 4.77
ACD/BCF (pH 7.4): 2496.85
ACD/KOC (pH 7.4): 9406.81
Polar Surface Area: 121 Å2
Polarizability: 53.2±0.5 10-24cm3
Surface Tension: 56.9±3.0 dyne/cm
Molar Volume: 369.0±3.0 cm3

Click to predict properties on the Chemicalize site


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