ChemSpider 2D Image | QUERCETIN-3'-O-PHOSPHATE | C15H11O10P

QUERCETIN-3'-O-PHOSPHATE

  • Molecular FormulaC15H11O10P
  • Average mass382.216 Da
  • Monoisotopic mass382.008972 Da
  • ChemSpider ID52085096

More details:

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

1111616-69-3 [RN]
2-Hydroxy-5-(3,5,7-trihydroxy-4-oxo-4H-chromen-2-yl)phenyl dihydrogen phosphate [ACD/IUPAC Name]
2-Hydroxy-5-(3,5,7-trihydroxy-4-oxo-4H-chromen-2-yl)phenyldihydrogenphosphat [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-[4-hydroxy-3-(phosphonooxy)phenyl]- [ACD/Index Name]
Dihydrogénophosphate de 2-hydroxy-5-(3,5,7-trihydroxy-4-oxo-4H-chromén-2-yl)phényle [French] [ACD/IUPAC Name]
QUERCETIN-3'-O-PHOSPHATE

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

E2I4458LJN [DBID]
UNII:E2I4458LJN [DBID]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 749.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.6±3.0 kJ/mol
Flash Point: 406.8±35.7 °C
Index of Refraction: 1.794
Molar Refractivity: 83.4±0.3 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: -0.19
ACD/LogD (pH 5.5): -3.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 184 Å2
Polarizability: 33.1±0.5 10-24cm3
Surface Tension: 127.0±3.0 dyne/cm
Molar Volume: 196.2±3.0 cm3

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