ChemSpider 2D Image | [(2S,3S)-3,5-Dihydroxy-2,8-bis(4-hydroxyphenyl)-3,4-dihydro-2H-furo[2,3-h]chromen-9-yl](2,4,6-trihydroxyphenyl)methanone | C30H22O10

[(2S,3S)-3,5-Dihydroxy-2,8-bis(4-hydroxyphenyl)-3,4-dihydro-2H-furo[2,3-h]chromen-9-yl](2,4,6-trihydroxyphenyl)methanone

  • Molecular FormulaC30H22O10
  • Average mass542.490 Da
  • Monoisotopic mass542.121277 Da
  • ChemSpider ID127384700

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

[(2S,3S)-3,5-Dihydroxy-2,8-bis(4-hydroxyphenyl)-3,4-dihydro-2H-furo[2,3-h]chromen-9-yl](2,4,6-trihydroxyphenyl)methanon [German] [ACD/IUPAC Name]
[(2S,3S)-3,5-Dihydroxy-2,8-bis(4-hydroxyphenyl)-3,4-dihydro-2H-furo[2,3-h]chromen-9-yl](2,4,6-trihydroxyphenyl)methanone [ACD/IUPAC Name]
[(2S,3S)-3,5-Dihydroxy-2,8-bis(4-hydroxyphényl)-3,4-dihydro-2H-furo[2,3-h]chromén-9-yl](2,4,6-trihydroxyphényl)méthanone [French] [ACD/IUPAC Name]
Methanone, [(2S,3S)-3,4-dihydro-3,5-dihydroxy-2,8-bis(4-hydroxyphenyl)-2H-furo[2,3-h]-1-benzopyran-9-yl](2,4,6-trihydroxyphenyl)- [ACD/Index Name]
[(2R,3S)-3,5-dihydroxy-2,8-bis(4-hydroxyphenyl)-3,4-dihydro-2H-furo[2,3-h]chromen-9-yl]-(2,4,6-trihydroxyphenyl)methanone
95733-02-1 [RN]
daphnodorin 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: 756.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 115.6±3.0 kJ/mol
Flash Point: 411.0±32.9 °C
Index of Refraction: 1.776
Molar Refractivity: 141.9±0.3 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 3
ACD/LogP: 4.48
ACD/LogD (pH 5.5): 3.82
ACD/BCF (pH 5.5): 448.94
ACD/KOC (pH 5.5): 2622.24
ACD/LogD (pH 7.4): 2.46
ACD/BCF (pH 7.4): 19.71
ACD/KOC (pH 7.4): 115.14
Polar Surface Area: 181 Å2
Polarizability: 56.2±0.5 10-24cm3
Surface Tension: 87.9±3.0 dyne/cm
Molar Volume: 339.4±3.0 cm3

Click to predict properties on the Chemicalize site


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