ChemSpider 2D Image | Poriol | C16H14O5

Poriol

  • Molecular FormulaC16H14O5
  • Average mass286.279 Da
  • Monoisotopic mass286.084137 Da
  • ChemSpider ID57643118

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-5,7-Dihydroxy-2-(4-hydroxyphenyl)-6-methyl-2,3-dihydro-4H-chromen-4-on [German] [ACD/IUPAC Name]
(2S)-5,7-Dihydroxy-2-(4-hydroxyphenyl)-6-methyl-2,3-dihydro-4H-chromen-4-one [ACD/IUPAC Name]
(2S)-5,7-Dihydroxy-2-(4-hydroxyphényl)-6-méthyl-2,3-dihydro-4H-chromén-4-one [French] [ACD/IUPAC Name]
14348-16-4 [RN]
4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2-(4-hydroxyphenyl)-6-methyl-, (2S)- [ACD/Index Name]
Poriol [Wiki]
(2S)-4',5,7-Trihydroxy-6-methylflavanone
(2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-6-methyl-2,3-dihydrochromen-4-one

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

Density: 1.4±0.1 g/cm3
Boiling Point: 588.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.1±3.0 kJ/mol
Flash Point: 225.4±23.6 °C
Index of Refraction: 1.676
Molar Refractivity: 75.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.65
ACD/LogD (pH 5.5): 2.92
ACD/BCF (pH 5.5): 97.18
ACD/KOC (pH 5.5): 918.96
ACD/LogD (pH 7.4): 2.70
ACD/BCF (pH 7.4): 58.88
ACD/KOC (pH 7.4): 556.78
Polar Surface Area: 87 Å2
Polarizability: 29.8±0.5 10-24cm3
Surface Tension: 68.3±3.0 dyne/cm
Molar Volume: 199.6±3.0 cm3

Click to predict properties on the Chemicalize site


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