ChemSpider 2D Image | (-)-satropane | C17H23NO5S

(-)-satropane

  • Molecular FormulaC17H23NO5S
  • Average mass353.433 Da
  • Monoisotopic mass353.129700 Da
  • ChemSpider ID24539380

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(-)-satropane

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

Density: 1.3±0.1 g/cm3
Boiling Point: 469.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.2±3.0 kJ/mol
Flash Point: 237.6±28.7 °C
Index of Refraction: 1.580
Molar Refractivity: 89.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.53
ACD/LogD (pH 5.5): -0.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.08
ACD/LogD (pH 7.4): 1.38
ACD/BCF (pH 7.4): 4.04
ACD/KOC (pH 7.4): 53.13
Polar Surface Area: 81 Å2
Polarizability: 35.6±0.5 10-24cm3
Surface Tension: 52.7±5.0 dyne/cm
Molar Volume: 269.9±5.0 cm3

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