ChemSpider 2D Image | 3',5,7-Trihydroxy-3,6-dimethoxy-2',2'-dimethyl-8'-(3-methyl-2-buten-1-yl)-3',4'-dihydro-2'H,4H-2,6'-bichromen-4-one | C27H30O8

3',5,7-Trihydroxy-3,6-dimethoxy-2',2'-dimethyl-8'-(3-methyl-2-buten-1-yl)-3',4'-dihydro-2'H,4H-2,6'-bichromen-4-one

  • Molecular FormulaC27H30O8
  • Average mass482.522 Da
  • Monoisotopic mass482.194061 Da
  • ChemSpider ID62782735

More details:

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

[2,6'-Bi-4H-1-benzopyran]-4-one, 2',3'-dihydro-3',5,7-trihydroxy-3,6-dimethoxy-2',2'-dimethyl-8'-(3-methyl-2-buten-1-yl)- [ACD/Index Name]
3',5,7-Trihydroxy-3,6-dimethoxy-2',2'-dimethyl-8'-(3-methyl-2-buten-1-yl)-3',4'-dihydro-2'H,4H-2,6'-bichromen-4-on [German] [ACD/IUPAC Name]
3',5,7-Trihydroxy-3,6-dimethoxy-2',2'-dimethyl-8'-(3-methyl-2-buten-1-yl)-3',4'-dihydro-2'H,4H-2,6'-bichromen-4-one [ACD/IUPAC Name]
3',5,7-Trihydroxy-3,6-diméthoxy-2',2'-diméthyl-8'-(3-méthyl-2-butén-1-yl)-3',4'-dihydro-2'H,4H-2,6'-bichromén-4-one [French] [ACD/IUPAC Name]
1616683-50-1 [RN]
Dodovisone A

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

Density: 1.4±0.1 g/cm3
Boiling Point: 711.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 109.2±3.0 kJ/mol
Flash Point: 238.4±26.4 °C
Index of Refraction: 1.641
Molar Refractivity: 127.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.31
ACD/LogD (pH 5.5): 3.96
ACD/BCF (pH 5.5): 578.24
ACD/KOC (pH 5.5): 3113.92
ACD/LogD (pH 7.4): 2.62
ACD/BCF (pH 7.4): 26.06
ACD/KOC (pH 7.4): 140.32
Polar Surface Area: 115 Å2
Polarizability: 50.6±0.5 10-24cm3
Surface Tension: 64.6±5.0 dyne/cm
Molar Volume: 353.7±5.0 cm3

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