ChemSpider 2D Image | (2R,3S,8S,9S)-2,8-Bis(3,4-dihydroxyphenyl)-9-(3,5-dihydroxyphenyl)-3,4,8,9-tetrahydro-2H-furo[2,3-h]chromene-3,5-diol | C29H24O10

(2R,3S,8S,9S)-2,8-Bis(3,4-dihydroxyphenyl)-9-(3,5-dihydroxyphenyl)-3,4,8,9-tetrahydro-2H-furo[2,3-h]chromene-3,5-diol

  • Molecular FormulaC29H24O10
  • Average mass532.495 Da
  • Monoisotopic mass532.136963 Da
  • ChemSpider ID23309880

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2R,3S,8S,9S)-2,8-Bis(3,4-dihydroxyphenyl)-9-(3,5-dihydroxyphenyl)-3,4,8,9-tetrahydro-2H-furo[2,3-h]chromen-3,5-diol [German] [ACD/IUPAC Name]
(2R,3S,8S,9S)-2,8-Bis(3,4-dihydroxyphenyl)-9-(3,5-dihydroxyphenyl)-3,4,8,9-tetrahydro-2H-furo[2,3-h]chromene-3,5-diol [ACD/IUPAC Name]
(2R,3S,8S,9S)-2,8-Bis(3,4-dihydroxyphényl)-9-(3,5-dihydroxyphényl)-3,4,8,9-tétrahydro-2H-furo[2,3-h]chromène-3,5-diol [French] [ACD/IUPAC Name]
2H-Furo[2,3-h]-1-benzopyran-3,5-diol, 2,8-bis(3,4-dihydroxyphenyl)-9-(3,5-dihydroxyphenyl)-3,4,8,9-tetrahydro-, (2R,3S,8S,9S)- [ACD/Index Name]
jezonocinol B

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

Density: 1.6±0.1 g/cm3
Boiling Point: 828.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 126.3±3.0 kJ/mol
Flash Point: 455.1±34.3 °C
Index of Refraction: 1.784
Molar Refractivity: 137.3±0.3 cm3
#H bond acceptors: 10
#H bond donors: 8
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 3
ACD/LogP: 1.20
ACD/LogD (pH 5.5): 1.54
ACD/BCF (pH 5.5): 8.70
ACD/KOC (pH 5.5): 163.72
ACD/LogD (pH 7.4): 1.52
ACD/BCF (pH 7.4): 8.31
ACD/KOC (pH 7.4): 156.27
Polar Surface Area: 180 Å2
Polarizability: 54.4±0.5 10-24cm3
Surface Tension: 96.2±3.0 dyne/cm
Molar Volume: 326.0±3.0 cm3

Click to predict properties on the Chemicalize site


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