ChemSpider 2D Image | 2-[(2,3-Dichlorophenoxy)methyl]-5-(2-fluorophenyl)-6-propylnicotinic acid | C22H18Cl2FNO3

2-[(2,3-Dichlorophenoxy)methyl]-5-(2-fluorophenyl)-6-propylnicotinic acid

  • Molecular FormulaC22H18Cl2FNO3
  • Average mass434.288 Da
  • Monoisotopic mass433.064789 Da
  • ChemSpider ID68371397

More details:






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

2-[(2,3-Dichlorophenoxy)methyl]-5-(2-fluorophenyl)-6-propylnicotinic acid [ACD/IUPAC Name]
2-[(2,3-Dichlorphenoxy)methyl]-5-(2-fluorphenyl)-6-propylnicotinsäure [German] [ACD/IUPAC Name]
3-Pyridinecarboxylic acid, 2-[(2,3-dichlorophenoxy)methyl]-5-(2-fluorophenyl)-6-propyl- [ACD/Index Name]
Acide 2-[(2,3-dichlorophénoxy)méthyl]-5-(2-fluorophényl)-6-propylnicotinique [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 565.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.3±3.0 kJ/mol
Flash Point: 295.5±30.1 °C
Index of Refraction: 1.604
Molar Refractivity: 111.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 7.11
ACD/LogD (pH 5.5): 4.11
ACD/BCF (pH 5.5): 216.44
ACD/KOC (pH 5.5): 358.39
ACD/LogD (pH 7.4): 3.31
ACD/BCF (pH 7.4): 34.22
ACD/KOC (pH 7.4): 56.67
Polar Surface Area: 59 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 50.7±3.0 dyne/cm
Molar Volume: 322.6±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement