ChemSpider 2D Image | 2-({4-[(2-Cyanoethyl)(ethyl)amino]phenyl}diazenyl)-5-nitrobenzonitrile | C18H16N6O2

2-({4-[(2-Cyanoethyl)(ethyl)amino]phenyl}diazenyl)-5-nitrobenzonitrile

  • Molecular FormulaC18H16N6O2
  • Average mass348.359 Da
  • Monoisotopic mass348.133484 Da
  • ChemSpider ID21160505

More details:

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

2-({4-[(2-Cyanethyl)(ethyl)amino]phenyl}diazenyl)-5-nitrobenzonitril [German] [ACD/IUPAC Name]
2-({4-[(2-Cyanoethyl)(ethyl)amino]phenyl}diazenyl)-5-nitrobenzonitrile [ACD/IUPAC Name]
2-({4-[(2-Cyanoéthyl)(éthyl)amino]phényl}diazényl)-5-nitrobenzonitrile [French] [ACD/IUPAC Name]
240-923-8 [EINECS]
Benzonitrile, 2-[2-[4-[(2-cyanoethyl)ethylamino]phenyl]diazenyl]-5-nitro- [ACD/Index Name]
16889-10-4 [RN]
2-[[4-[(2-cyanoethyl)ethylamino]phenyl]azo]-5-nitrobenzonitrile

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

Density: 1.2±0.1 g/cm3
Boiling Point: 614.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.1±3.0 kJ/mol
Flash Point: 325.3±31.5 °C
Index of Refraction: 1.621
Molar Refractivity: 99.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.71
ACD/LogD (pH 5.5): 4.27
ACD/BCF (pH 5.5): 1027.50
ACD/KOC (pH 5.5): 4981.74
ACD/LogD (pH 7.4): 4.27
ACD/BCF (pH 7.4): 1027.93
ACD/KOC (pH 7.4): 4983.83
Polar Surface Area: 121 Å2
Polarizability: 39.6±0.5 10-24cm3
Surface Tension: 53.2±7.0 dyne/cm
Molar Volume: 283.5±7.0 cm3

Click to predict properties on the Chemicalize site


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