ChemSpider 2D Image | N-(3-Chlorophenyl)-4-methyl-2-[4-(trifluoromethyl)phenyl]-5-pyrimidinecarboxamide | C19H13ClF3N3O

N-(3-Chlorophenyl)-4-methyl-2-[4-(trifluoromethyl)phenyl]-5-pyrimidinecarboxamide

  • Molecular FormulaC19H13ClF3N3O
  • Average mass391.774 Da
  • Monoisotopic mass391.069916 Da
  • ChemSpider ID28977729

More details:

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

5-Pyrimidinecarboxamide, N-(3-chlorophenyl)-4-methyl-2-[4-(trifluoromethyl)phenyl]- [ACD/Index Name]
N-(3-Chlorophenyl)-4-methyl-2-[4-(trifluoromethyl)phenyl]-5-pyrimidinecarboxamide [ACD/IUPAC Name]
N-(3-Chlorophényl)-4-méthyl-2-[4-(trifluorométhyl)phényl]-5-pyrimidinecarboxamide [French] [ACD/IUPAC Name]
N-(3-Chlorphenyl)-4-methyl-2-[4-(trifluormethyl)phenyl]-5-pyrimidincarboxamid [German] [ACD/IUPAC Name]
N-(3-CHLOROPHENYL)-4-METHYL-2-[4-(TRIFLUOROMETHYL)PHENYL]PYRIMIDINE-5-CARBOXAMIDE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 365.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.2±3.0 kJ/mol
Flash Point: 174.7±27.9 °C
Index of Refraction: 1.599
Molar Refractivity: 96.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.28
ACD/LogD (pH 5.5): 4.95
ACD/BCF (pH 5.5): 3419.35
ACD/KOC (pH 5.5): 11781.18
ACD/LogD (pH 7.4): 4.95
ACD/BCF (pH 7.4): 3415.74
ACD/KOC (pH 7.4): 11768.75
Polar Surface Area: 55 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 47.4±3.0 dyne/cm
Molar Volume: 281.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement