ChemSpider 2D Image | 1,3-Bis[(4-fluorophenyl)sulfonyl]-5-methylenehexahydropyrimidine | C17H16F2N2O4S2

1,3-Bis[(4-fluorophenyl)sulfonyl]-5-methylenehexahydropyrimidine

  • Molecular FormulaC17H16F2N2O4S2
  • Average mass414.447 Da
  • Monoisotopic mass414.051941 Da
  • ChemSpider ID21131494

More details:

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

1,3-Bis[(4-fluorophenyl)sulfonyl]-5-methylenehexahydropyrimidine [ACD/IUPAC Name]
1,3-Bis[(4-fluorophényl)sulfonyl]-5-méthylènehexahydropyrimidine [French] [ACD/IUPAC Name]
1,3-Bis[(4-fluorphenyl)sulfonyl]-5-methylenhexahydropyrimidin [German] [ACD/IUPAC Name]
Pyrimidine, 1,3-bis[(4-fluorophenyl)sulfonyl]hexahydro-5-methylene- [ACD/Index Name]
627081-21-4 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 550.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.1±3.0 kJ/mol
Flash Point: 287.0±32.9 °C
Index of Refraction: 1.646
Molar Refractivity: 97.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.19
ACD/LogD (pH 5.5): 3.18
ACD/BCF (pH 5.5): 154.83
ACD/KOC (pH 5.5): 1285.58
ACD/LogD (pH 7.4): 3.18
ACD/BCF (pH 7.4): 154.83
ACD/KOC (pH 7.4): 1285.58
Polar Surface Area: 92 Å2
Polarizability: 38.7±0.5 10-24cm3
Surface Tension: 63.7±5.0 dyne/cm
Molar Volume: 269.2±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement