ChemSpider 2D Image | 2-Chloro-4-(3-oxetanylsulfanyl)-6-(trifluoromethyl)pyrimidine | C8H6ClF3N2OS

2-Chloro-4-(3-oxetanylsulfanyl)-6-(trifluoromethyl)pyrimidine

  • Molecular FormulaC8H6ClF3N2OS
  • Average mass270.659 Da
  • Monoisotopic mass269.984131 Da
  • ChemSpider ID42970142

More details:

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

2-Chlor-4-(3-oxetanylsulfanyl)-6-(trifluormethyl)pyrimidin [German] [ACD/IUPAC Name]
2-Chloro-4-(3-oxetanylsulfanyl)-6-(trifluoromethyl)pyrimidine [ACD/IUPAC Name]
2-Chloro-4-(3-oxétanylsulfanyl)-6-(trifluorométhyl)pyrimidine [French] [ACD/IUPAC Name]
Pyrimidine, 2-chloro-4-(3-oxetanylthio)-6-(trifluoromethyl)- [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: 376.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.9±3.0 kJ/mol
Flash Point: 181.2±27.9 °C
Index of Refraction: 1.544
Molar Refractivity: 53.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.12
ACD/LogD (pH 5.5): 2.01
ACD/BCF (pH 5.5): 19.93
ACD/KOC (pH 5.5): 296.40
ACD/LogD (pH 7.4): 2.01
ACD/BCF (pH 7.4): 19.93
ACD/KOC (pH 7.4): 296.40
Polar Surface Area: 60 Å2
Polarizability: 21.3±0.5 10-24cm3
Surface Tension: 51.0±5.0 dyne/cm
Molar Volume: 170.3±5.0 cm3

Click to predict properties on the Chemicalize site


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