ChemSpider 2D Image | 4-Chloro-6-[3-(methylsulfonyl)phenoxy]-5-nitropyrimidine | C11H8ClN3O5S

4-Chloro-6-[3-(methylsulfonyl)phenoxy]-5-nitropyrimidine

  • Molecular FormulaC11H8ClN3O5S
  • Average mass329.716 Da
  • Monoisotopic mass328.987305 Da
  • ChemSpider ID39606748

More details:

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

4-Chlor-6-[3-(methylsulfonyl)phenoxy]-5-nitropyrimidin [German] [ACD/IUPAC Name]
4-Chloro-6-[3-(methylsulfonyl)phenoxy]-5-nitropyrimidine [ACD/IUPAC Name]
4-Chloro-6-[3-(méthylsulfonyl)phénoxy]-5-nitropyrimidine [French] [ACD/IUPAC Name]
Pyrimidine, 4-chloro-6-[3-(methylsulfonyl)phenoxy]-5-nitro- [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: 541.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 78.8±3.0 kJ/mol
Flash Point: 281.2±30.1 °C
Index of Refraction: 1.606
Molar Refractivity: 73.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.86
ACD/LogD (pH 5.5): 1.42
ACD/BCF (pH 5.5): 7.03
ACD/KOC (pH 5.5): 140.56
ACD/LogD (pH 7.4): 1.42
ACD/BCF (pH 7.4): 7.03
ACD/KOC (pH 7.4): 140.56
Polar Surface Area: 123 Å2
Polarizability: 29.0±0.5 10-24cm3
Surface Tension: 64.6±3.0 dyne/cm
Molar Volume: 212.0±3.0 cm3

Click to predict properties on the Chemicalize site


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