ChemSpider 2D Image | 3-Iodoandrosta-3,5-dien-17-ol | C19H27IO

3-Iodoandrosta-3,5-dien-17-ol

  • Molecular FormulaC19H27IO
  • Average mass398.322 Da
  • Monoisotopic mass398.110657 Da
  • ChemSpider ID67497364

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

3-Iodandrosta-3,5-dien-17-ol [German] [ACD/IUPAC Name]
3-Iodoandrosta-3,5-dien-17-ol [ACD/IUPAC Name]
3-Iodoandrosta-3,5-dién-17-ol [French] [ACD/IUPAC Name]
Androsta-3,5-dien-17-ol, 3-iodo- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 461.7±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 83.3±6.0 kJ/mol
Flash Point: 233.0±25.7 °C
Index of Refraction: 1.618
Molar Refractivity: 95.6±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 6.27
ACD/LogD (pH 5.5): 5.30
ACD/BCF (pH 5.5): 6263.15
ACD/KOC (pH 5.5): 18169.21
ACD/LogD (pH 7.4): 5.30
ACD/BCF (pH 7.4): 6263.15
ACD/KOC (pH 7.4): 18169.21
Polar Surface Area: 20 Å2
Polarizability: 37.9±0.5 10-24cm3
Surface Tension: 47.8±5.0 dyne/cm
Molar Volume: 273.1±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement