ChemSpider 2D Image | (5S)-5-Hydroxy-7-(4-hydroxyphenyl)-1-phenyl-3-heptanone | C19H22O3

(5S)-5-Hydroxy-7-(4-hydroxyphenyl)-1-phenyl-3-heptanone

  • Molecular FormulaC19H22O3
  • Average mass298.376 Da
  • Monoisotopic mass298.156891 Da
  • ChemSpider ID67168367

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(5S)-5-Hydroxy-7-(4-hydroxyphenyl)-1-phenyl-3-heptanon [German] [ACD/IUPAC Name]
(5S)-5-Hydroxy-7-(4-hydroxyphenyl)-1-phenyl-3-heptanone [ACD/IUPAC Name]
(5S)-5-Hydroxy-7-(4-hydroxyphényl)-1-phényl-3-heptanone [French] [ACD/IUPAC Name]
3-Heptanone, 5-hydroxy-7-(4-hydroxyphenyl)-1-phenyl-, (5S)- [ACD/Index Name]
(5s)-5-hydroxy-7-(4-hydroxyphenyl)-1-phenylhept-3-one

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

Density: 1.2±0.1 g/cm3
Boiling Point: 523.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.9±3.0 kJ/mol
Flash Point: 284.6±25.2 °C
Index of Refraction: 1.586
Molar Refractivity: 86.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.82
ACD/LogD (pH 5.5): 2.68
ACD/BCF (pH 5.5): 64.51
ACD/KOC (pH 5.5): 686.99
ACD/LogD (pH 7.4): 2.68
ACD/BCF (pH 7.4): 64.38
ACD/KOC (pH 7.4): 685.55
Polar Surface Area: 58 Å2
Polarizability: 34.4±0.5 10-24cm3
Surface Tension: 50.2±3.0 dyne/cm
Molar Volume: 258.9±3.0 cm3

Click to predict properties on the Chemicalize site


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