ChemSpider 2D Image | 3-[(2,6-Dichlorobenzyl)oxy]-4-nitrobenzoic acid | C14H9Cl2NO5

3-[(2,6-Dichlorobenzyl)oxy]-4-nitrobenzoic acid

  • Molecular FormulaC14H9Cl2NO5
  • Average mass342.131 Da
  • Monoisotopic mass340.985779 Da
  • ChemSpider ID24488206

More details:

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

3-[(2,6-Dichlorbenzyl)oxy]-4-nitrobenzoesäure [German] [ACD/IUPAC Name]
3-[(2,6-Dichlorobenzyl)oxy]-4-nitrobenzoic acid [ACD/IUPAC Name]
Acide 3-[(2,6-dichlorobenzyl)oxy]-4-nitrobenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-[(2,6-dichlorophenyl)methoxy]-4-nitro- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 543.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.4±3.0 kJ/mol
Flash Point: 282.3±30.1 °C
Index of Refraction: 1.646
Molar Refractivity: 80.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.74
ACD/LogD (pH 5.5): 2.95
ACD/BCF (pH 5.5): 29.77
ACD/KOC (pH 5.5): 91.81
ACD/LogD (pH 7.4): 2.06
ACD/BCF (pH 7.4): 3.91
ACD/KOC (pH 7.4): 12.05
Polar Surface Area: 92 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 62.5±3.0 dyne/cm
Molar Volume: 222.4±3.0 cm3

Click to predict properties on the Chemicalize site


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