ChemSpider 2D Image | 2',4',5,7-Tetrahydroxyisoflavanone | C15H12O6

2',4',5,7-Tetrahydroxyisoflavanone

  • Molecular FormulaC15H12O6
  • Average mass288.252 Da
  • Monoisotopic mass288.063385 Da
  • ChemSpider ID65322704

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,3R)-2,5,7-Trihydroxy-3-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-on [German] [ACD/IUPAC Name]
(2R,3R)-2,5,7-Trihydroxy-3-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one [ACD/IUPAC Name]
(2R,3R)-2,5,7-Trihydroxy-3-(4-hydroxyphényl)-2,3-dihydro-4H-chromén-4-one [French] [ACD/IUPAC Name]
2',4',5,7-Tetrahydroxyisoflavanone
4H-1-Benzopyran-4-one, 2,3-dihydro-2,5,7-trihydroxy-3-(4-hydroxyphenyl)-, (2R,3R)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 639.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.2±3.0 kJ/mol
Flash Point: 247.4±25.0 °C
Index of Refraction: 1.729
Molar Refractivity: 71.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.23
ACD/LogD (pH 5.5): 1.76
ACD/BCF (pH 5.5): 12.80
ACD/KOC (pH 5.5): 214.48
ACD/LogD (pH 7.4): 1.30
ACD/BCF (pH 7.4): 4.38
ACD/KOC (pH 7.4): 73.38
Polar Surface Area: 107 Å2
Polarizability: 28.5±0.5 10-24cm3
Surface Tension: 87.0±3.0 dyne/cm
Molar Volume: 180.3±3.0 cm3

Click to predict properties on the Chemicalize site


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