ChemSpider 2D Image | 2-[2-[4-[Bis[2-(acetyloxy)ethyl]amino]-2-chlorophenyl]diazenyl]-5-nitrobenzonitrile | C21H20ClN5O6

2-[2-[4-[Bis[2-(acetyloxy)ethyl]amino]-2-chlorophenyl]diazenyl]-5-nitrobenzonitrile

  • Molecular FormulaC21H20ClN5O6
  • Average mass473.866 Da
  • Monoisotopic mass473.110199 Da
  • ChemSpider ID62919469

  • Double-bond stereo - Double-bond stereo

More details:

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

({3-Chlor-4-[(E)-(2-cyan-4-nitrophenyl)diazenyl]phenyl}imino)di-2,1-ethandiyl-diacetat [German] [ACD/IUPAC Name]
({3-Chloro-4-[(E)-(2-cyano-4-nitrophenyl)diazenyl]phenyl}imino)di-2,1-ethanediyl diacetate [ACD/IUPAC Name]
2-[2-[4-[Bis[2-(acetyloxy)ethyl]amino]-2-chlorophenyl]diazenyl]-5-nitrobenzonitrile
73755-70-1 [RN]
Benzonitrile, 2-[(E)-2-[4-[bis[2-(acetyloxy)ethyl]amino]-2-chlorophenyl]diazenyl]-5-nitro- [ACD/Index Name]
Diacétate de ({3-chloro-4-[(E)-(2-cyano-4-nitrophényl)diazényl]phényl}imino)di-2,1-éthanediyle [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: 642.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.8±3.0 kJ/mol
Flash Point: 342.2±31.5 °C
Index of Refraction: 1.604
Molar Refractivity: 120.6±0.5 cm3
#H bond acceptors: 11
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 5.66
ACD/LogD (pH 5.5): 5.12
ACD/BCF (pH 5.5): 4558.92
ACD/KOC (pH 5.5): 14474.56
ACD/LogD (pH 7.4): 5.12
ACD/BCF (pH 7.4): 4558.95
ACD/KOC (pH 7.4): 14474.66
Polar Surface Area: 150 Å2
Polarizability: 47.8±0.5 10-24cm3
Surface Tension: 52.8±7.0 dyne/cm
Molar Volume: 350.8±7.0 cm3

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