ChemSpider 2D Image | 2-(2,4-Dichlorophenoxy)benzoic acid | C13H8Cl2O3

2-(2,4-Dichlorophenoxy)benzoic acid

  • Molecular FormulaC13H8Cl2O3
  • Average mass283.107 Da
  • Monoisotopic mass281.985046 Da
  • ChemSpider ID23124760

More details:

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

2-(2,4-Dichlorophenoxy)benzoic acid [ACD/IUPAC Name]
2-(2,4-Dichlorphenoxy)benzoesäure [German] [ACD/IUPAC Name]
86308-86-3 [RN]
Acide 2-(2,4-dichlorophénoxy)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-(2,4-dichlorophenoxy)- [ACD/Index Name]
2-(2,4-Dichloro-phenoxy)-benzoic acid
2,4-dichlorophenoxybenzoic acid
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL283059/
MFCD06208090 [MDL number]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 381.6±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 66.4±3.0 kJ/mol
Flash Point: 184.6±26.5 °C
Index of Refraction: 1.625
Molar Refractivity: 69.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.08
ACD/LogD (pH 5.5): 2.92
ACD/BCF (pH 5.5): 28.01
ACD/KOC (pH 5.5): 86.38
ACD/LogD (pH 7.4): 2.06
ACD/BCF (pH 7.4): 3.89
ACD/KOC (pH 7.4): 11.98
Polar Surface Area: 47 Å2
Polarizability: 27.5±0.5 10-24cm3
Surface Tension: 53.9±3.0 dyne/cm
Molar Volume: 196.5±3.0 cm3

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