ChemSpider 2D Image | (2R,3R,4R)-2-(3,4-Dihydroxyphenyl)-3,4,7-chromanetriol | C15H14O6

(2R,3R,4R)-2-(3,4-Dihydroxyphenyl)-3,4,7-chromanetriol

  • Molecular FormulaC15H14O6
  • Average mass290.268 Da
  • Monoisotopic mass290.079041 Da
  • ChemSpider ID24842600

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2R,3R,4R)-2-(3,4-Dihydroxyphenyl)-3,4,7-chromanetriol [ACD/IUPAC Name]
(2R,3R,4R)-2-(3,4-Dihydroxyphényl)-3,4,7-chromanetriol [French] [ACD/IUPAC Name]
(2R,3R,4R)-2-(3,4-Dihydroxyphenyl)-3,4,7-chromantriol [German] [ACD/IUPAC Name]
2H-1-Benzopyran-3,4,7-triol, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-, (2R,3R,4R)- [ACD/Index Name]
2H-1-BENZOPYRAN-3,4,7-TRIOL, 2-(3,4-DIHYDROXYPHENYL)-3,4-DIHYDRO-,(2R,3R,4R)-
Epifisetinidol-4α-ol

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

Density: 1.6±0.1 g/cm3
Boiling Point: 583.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.7±3.0 kJ/mol
Flash Point: 306.5±30.1 °C
Index of Refraction: 1.745
Molar Refractivity: 73.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 0.46
ACD/LogD (pH 5.5): 0.40
ACD/BCF (pH 5.5): 1.19
ACD/KOC (pH 5.5): 39.51
ACD/LogD (pH 7.4): 0.40
ACD/BCF (pH 7.4): 1.17
ACD/KOC (pH 7.4): 38.77
Polar Surface Area: 110 Å2
Polarizability: 29.1±0.5 10-24cm3
Surface Tension: 85.7±3.0 dyne/cm
Molar Volume: 180.8±3.0 cm3

Click to predict properties on the Chemicalize site


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