ChemSpider 2D Image | (E)-2-Iodo-1-{2-[methyl(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]ethoxy}ethenol | C11H11IN4O5

(E)-2-Iodo-1-{2-[methyl(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]ethoxy}ethenol

  • Molecular FormulaC11H11IN4O5
  • Average mass406.133 Da
  • Monoisotopic mass405.977417 Da
  • ChemSpider ID95566410

More details:

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

(E)-2-Iod-1-{2-[methyl(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]ethoxy}ethenol [German] [ACD/IUPAC Name]
(E)-2-Iodo-1-{2-[methyl(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]ethoxy}ethenol [ACD/IUPAC Name]
(E)-2-Iodo-1-{2-[méthyl(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]éthoxy}éthénol [French] [ACD/IUPAC Name]
Ethenol, 2-iodo-1-[2-[methyl(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]ethoxy]-, (E)- [ACD/Index Name]

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

Density: 2.0±0.1 g/cm3
Boiling Point: 530.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.8±3.0 kJ/mol
Flash Point: 274.6±32.9 °C
Index of Refraction: 1.734
Molar Refractivity: 83.5±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.97
ACD/LogD (pH 5.5): 2.35
ACD/BCF (pH 5.5): 35.92
ACD/KOC (pH 5.5): 451.73
ACD/LogD (pH 7.4): 2.33
ACD/BCF (pH 7.4): 34.14
ACD/KOC (pH 7.4): 429.30
Polar Surface Area: 117 Å2
Polarizability: 33.1±0.5 10-24cm3
Surface Tension: 80.6±3.0 dyne/cm
Molar Volume: 208.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement