ChemSpider 2D Image | 4-[(5-Fluoro-3-pyridinyl)sulfonyl]-1-thia-4-azaspiro[5.5]undecane | C14H19FN2O2S2

4-[(5-Fluoro-3-pyridinyl)sulfonyl]-1-thia-4-azaspiro[5.5]undecane

  • Molecular FormulaC14H19FN2O2S2
  • Average mass330.441 Da
  • Monoisotopic mass330.087189 Da
  • ChemSpider ID30285632

More details:

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

1-Thia-4-azaspiro[5.5]undecane, 4-[(5-fluoro-3-pyridinyl)sulfonyl]- [ACD/Index Name]
4-[(5-Fluor-3-pyridinyl)sulfonyl]-1-thia-4-azaspiro[5.5]undecan [German] [ACD/IUPAC Name]
4-[(5-Fluoro-3-pyridinyl)sulfonyl]-1-thia-4-azaspiro[5.5]undecane [ACD/IUPAC Name]
4-[(5-Fluoro-3-pyridinyl)sulfonyl]-1-thia-4-azaspiro[5.5]undécane [French] [ACD/IUPAC Name]
4-(5-FLUOROPYRIDIN-3-YLSULFONYL)-1-THIA-4-AZASPIRO[5.5]UNDECANE
4-[(5-FLUOROPYRIDIN-3-YL)SULFONYL]-1-THIA-4-AZASPIRO[5.5]UNDECANE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 492.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.9±3.0 kJ/mol
Flash Point: 251.3±31.5 °C
Index of Refraction: 1.614
Molar Refractivity: 83.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.31
ACD/LogD (pH 5.5): 3.45
ACD/BCF (pH 5.5): 248.65
ACD/KOC (pH 5.5): 1804.56
ACD/LogD (pH 7.4): 3.45
ACD/BCF (pH 7.4): 248.66
ACD/KOC (pH 7.4): 1804.58
Polar Surface Area: 84 Å2
Polarizability: 32.9±0.5 10-24cm3
Surface Tension: 60.1±5.0 dyne/cm
Molar Volume: 238.1±5.0 cm3

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