ChemSpider 2D Image | 3-Chloro-5-(3-chloro-5-hydroxyphenoxy)benzonitrile | C13H7Cl2NO2

3-Chloro-5-(3-chloro-5-hydroxyphenoxy)benzonitrile

  • Molecular FormulaC13H7Cl2NO2
  • Average mass280.106 Da
  • Monoisotopic mass278.985382 Da
  • ChemSpider ID28560771

More details:

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

3-Chlor-5-(3-chlor-5-hydroxyphenoxy)benzonitril [German] [ACD/IUPAC Name]
3-Chloro-5-(3-chloro-5-hydroxyphenoxy)benzonitrile [ACD/IUPAC Name]
3-Chloro-5-(3-chloro-5-hydroxyphénoxy)benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 3-chloro-5-(3-chloro-5-hydroxyphenoxy)- [ACD/Index Name]
920036-08-4 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 410.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.8±3.0 kJ/mol
Flash Point: 201.8±28.7 °C
Index of Refraction: 1.665
Molar Refractivity: 69.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.31
ACD/LogD (pH 5.5): 5.17
ACD/BCF (pH 5.5): 5036.05
ACD/KOC (pH 5.5): 15535.60
ACD/LogD (pH 7.4): 5.12
ACD/BCF (pH 7.4): 4417.48
ACD/KOC (pH 7.4): 13627.38
Polar Surface Area: 53 Å2
Polarizability: 27.3±0.5 10-24cm3
Surface Tension: 69.0±5.0 dyne/cm
Molar Volume: 185.6±5.0 cm3

Click to predict properties on the Chemicalize site


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