ChemSpider 2D Image | 2-Chloro-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4-nitroaniline | C11H11ClN4O3

2-Chloro-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4-nitroaniline

  • Molecular FormulaC11H11ClN4O3
  • Average mass282.683 Da
  • Monoisotopic mass282.051971 Da
  • ChemSpider ID26157331

More details:

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

1,2,4-Oxadiazole-5-ethanamine, N-(2-chloro-4-nitrophenyl)-3-methyl- [ACD/Index Name]
2-Chlor-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4-nitroanilin [German] [ACD/IUPAC Name]
2-Chloro-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4-nitroaniline [ACD/IUPAC Name]
2-Chloro-N-[2-(3-méthyl-1,2,4-oxadiazol-5-yl)éthyl]-4-nitroaniline [French] [ACD/IUPAC 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: 487.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.4±3.0 kJ/mol
Flash Point: 248.8±31.5 °C
Index of Refraction: 1.632
Molar Refractivity: 69.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.19
ACD/LogD (pH 5.5): 2.46
ACD/BCF (pH 5.5): 43.34
ACD/KOC (pH 5.5): 516.80
ACD/LogD (pH 7.4): 2.46
ACD/BCF (pH 7.4): 43.34
ACD/KOC (pH 7.4): 516.80
Polar Surface Area: 97 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 62.5±3.0 dyne/cm
Molar Volume: 195.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement