ChemSpider 2D Image | 5-(3,4-Dichlorophenoxy)-2-nitrobenzoic acid | C13H7Cl2NO5

5-(3,4-Dichlorophenoxy)-2-nitrobenzoic acid

  • Molecular FormulaC13H7Cl2NO5
  • Average mass328.104 Da
  • Monoisotopic mass326.970123 Da
  • ChemSpider ID24382802

More details:

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

5-(3,4-Dichlorophenoxy)-2-nitrobenzoic acid [ACD/IUPAC Name]
5-(3,4-Dichlorphenoxy)-2-nitrobenzoesäure [German] [ACD/IUPAC Name]
Acide 5-(3,4-dichlorophénoxy)-2-nitrobenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 5-(3,4-dichlorophenoxy)-2-nitro- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 477.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.1±3.0 kJ/mol
Flash Point: 242.7±28.7 °C
Index of Refraction: 1.650
Molar Refractivity: 76.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.75
ACD/LogD (pH 5.5): 1.65
ACD/BCF (pH 5.5): 2.02
ACD/KOC (pH 5.5): 8.02
ACD/LogD (pH 7.4): 1.51
ACD/BCF (pH 7.4): 1.47
ACD/KOC (pH 7.4): 5.83
Polar Surface Area: 92 Å2
Polarizability: 30.1±0.5 10-24cm3
Surface Tension: 63.4±3.0 dyne/cm
Molar Volume: 208.3±3.0 cm3

Click to predict properties on the Chemicalize site


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