ChemSpider 2D Image | (2S,3R)-2'-(3,4-Dimethoxyphenyl)-5,5',7,7'-tetramethoxy-2-(4-methoxyphenyl)-2,3-dihydro-4H,4'H-3,8'-bichromene-4,4'-dione | C37H34O11

(2S,3R)-2'-(3,4-Dimethoxyphenyl)-5,5',7,7'-tetramethoxy-2-(4-methoxyphenyl)-2,3-dihydro-4H,4'H-3,8'-bichromene-4,4'-dione

  • Molecular FormulaC37H34O11
  • Average mass654.659 Da
  • Monoisotopic mass654.210083 Da
  • ChemSpider ID410420

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,3R)-2'-(3,4-Dimethoxyphenyl)-5,5',7,7'-tetramethoxy-2-(4-methoxyphenyl)-2,3-dihydro-4H,4'H-3,8'-bichromen-4,4'-dion [German] [ACD/IUPAC Name]
(2S,3R)-2'-(3,4-Dimethoxyphenyl)-5,5',7,7'-tetramethoxy-2-(4-methoxyphenyl)-2,3-dihydro-4H,4'H-3,8'-bichromene-4,4'-dione [ACD/IUPAC Name]
(2S,3R)-2'-(3,4-Diméthoxyphényl)-5,5',7,7'-tétraméthoxy-2-(4-méthoxyphényl)-2,3-dihydro-4H,4'H-3,8'-bichromène-4,4'-dione [French] [ACD/IUPAC Name]
[3,8'-Bi-4H-1-benzopyran]-4,4'-dione, 2'-(3,4-dimethoxyphenyl)-2,3-dihydro-5,5',7,7'-tetramethoxy-2-(4-methoxyphenyl)-, (2S,3R)- [ACD/Index Name]
Morelloflavone heptamethylether

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

AIDS051084 [DBID]
AIDS-051084 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 825.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 120.0±3.0 kJ/mol
Flash Point: 337.5±34.3 °C
Index of Refraction: 1.597
Molar Refractivity: 173.8±0.3 cm3
#H bond acceptors: 11
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 6.45
ACD/LogD (pH 5.5): 5.18
ACD/BCF (pH 5.5): 5095.45
ACD/KOC (pH 5.5): 15674.50
ACD/LogD (pH 7.4): 5.18
ACD/BCF (pH 7.4): 5095.45
ACD/KOC (pH 7.4): 15674.50
Polar Surface Area: 117 Å2
Polarizability: 68.9±0.5 10-24cm3
Surface Tension: 48.0±3.0 dyne/cm
Molar Volume: 510.0±3.0 cm3

Click to predict properties on the Chemicalize site


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