ChemSpider 2D Image | (2R,3R)-3-(4-Fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1-indanone | C23H19FO3

(2R,3R)-3-(4-Fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1-indanone

  • Molecular FormulaC23H19FO3
  • Average mass362.394 Da
  • Monoisotopic mass362.131836 Da
  • ChemSpider ID58913213

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,3R)-3-(4-Fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1-indanone [ACD/IUPAC Name]
(2R,3R)-3-(4-Fluorophényl)-5-méthoxy-2-(4-méthoxyphényl)-1-indanone [French] [ACD/IUPAC Name]
(2R,3R)-3-(4-Fluorphenyl)-5-methoxy-2-(4-methoxyphenyl)-1-indanon [German] [ACD/IUPAC Name]
1H-Inden-1-one, 3-(4-fluorophenyl)-2,3-dihydro-5-methoxy-2-(4-methoxyphenyl)-, (2R,3R)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 474.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.8±3.0 kJ/mol
Flash Point: 232.1±23.6 °C
Index of Refraction: 1.598
Molar Refractivity: 100.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.61
ACD/LogD (pH 5.5): 5.38
ACD/BCF (pH 5.5): 7207.77
ACD/KOC (pH 5.5): 20091.15
ACD/LogD (pH 7.4): 5.38
ACD/BCF (pH 7.4): 7207.77
ACD/KOC (pH 7.4): 20091.15
Polar Surface Area: 36 Å2
Polarizability: 40.0±0.5 10-24cm3
Surface Tension: 45.1±3.0 dyne/cm
Molar Volume: 295.6±3.0 cm3

Click to predict properties on the Chemicalize site


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