ChemSpider 2D Image | (2R)-5,7-Dihydroxy-6-(2-hydroxybenzyl)-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one | C22H18O6

(2R)-5,7-Dihydroxy-6-(2-hydroxybenzyl)-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one

  • Molecular FormulaC22H18O6
  • Average mass378.375 Da
  • Monoisotopic mass378.110352 Da
  • ChemSpider ID26336923

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-5,7-Dihydroxy-6-(2-hydroxybenzyl)-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-on [German] [ACD/IUPAC Name]
(2R)-5,7-Dihydroxy-6-(2-hydroxybenzyl)-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one [ACD/IUPAC Name]
(2R)-5,7-Dihydroxy-6-(2-hydroxybenzyl)-2-(4-hydroxyphényl)-2,3-dihydro-4H-chromén-4-one [French] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2-(4-hydroxyphenyl)-6-[(2-hydroxyphenyl)methyl]-, (2R)- [ACD/Index Name]
Epi-phelligrin A

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

Density: 1.4±0.1 g/cm3
Boiling Point: 709.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.5±3.0 kJ/mol
Flash Point: 255.9±26.4 °C
Index of Refraction: 1.705
Molar Refractivity: 101.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.44
ACD/LogD (pH 5.5): 3.81
ACD/BCF (pH 5.5): 461.86
ACD/KOC (pH 5.5): 2794.83
ACD/LogD (pH 7.4): 3.39
ACD/BCF (pH 7.4): 173.55
ACD/KOC (pH 7.4): 1050.22
Polar Surface Area: 107 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 72.9±3.0 dyne/cm
Molar Volume: 261.1±3.0 cm3

Click to predict properties on the Chemicalize site


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