ChemSpider 2D Image | 3,4-Dihydroxy-5-(3-nitrophenoxy)benzoic acid | C13H9NO7

3,4-Dihydroxy-5-(3-nitrophenoxy)benzoic acid

  • Molecular FormulaC13H9NO7
  • Average mass291.213 Da
  • Monoisotopic mass291.037903 Da
  • ChemSpider ID35033965

More details:

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

3,4-Dihydroxy-5-(3-nitrophenoxy)benzoesäure [German] [ACD/IUPAC Name]
3,4-Dihydroxy-5-(3-nitrophenoxy)benzoic acid [ACD/IUPAC Name]
Acide 3,4-dihydroxy-5-(3-nitrophénoxy)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3,4-dihydroxy-5-(3-nitrophenoxy)- [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: 511.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.4±3.0 kJ/mol
Flash Point: 263.0±30.1 °C
Index of Refraction: 1.698
Molar Refractivity: 69.9±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.27
ACD/LogD (pH 5.5): 1.14
ACD/BCF (pH 5.5): 1.83
ACD/KOC (pH 5.5): 19.15
ACD/LogD (pH 7.4): -0.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 133 Å2
Polarizability: 27.7±0.5 10-24cm3
Surface Tension: 82.4±3.0 dyne/cm
Molar Volume: 181.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement