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

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

  • Molecular FormulaC13H7Cl2NO5
  • Average mass328.104 Da
  • Monoisotopic mass326.970123 Da
  • ChemSpider ID24274523

More details:

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

4-(2,5-Dichlorophenoxy)-3-nitrobenzoic acid [ACD/IUPAC Name]
4-(2,5-Dichlorphenoxy)-3-nitrobenzoesäure [German] [ACD/IUPAC Name]
Acide 4-(2,5-dichlorophénoxy)-3-nitrobenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-(2,5-dichlorophenoxy)-3-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: 443.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.9±3.0 kJ/mol
Flash Point: 221.8±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: 3.83
ACD/LogD (pH 5.5): 2.20
ACD/BCF (pH 5.5): 9.69
ACD/KOC (pH 5.5): 50.44
ACD/LogD (pH 7.4): 1.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.55
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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