ChemSpider 2D Image | 5,5',7,7'-Tetrahydroxy-2,2'-bis(3,4,5-trihydroxyphenyl)-3,3',4,4'-tetrahydro-2H,2'H-4,8'-bichromene-3,3'-diyl bis(3,4,5-trihydroxybenzoate) | C44H34O22

5,5',7,7'-Tetrahydroxy-2,2'-bis(3,4,5-trihydroxyphenyl)-3,3',4,4'-tetrahydro-2H,2'H-4,8'-bichromene-3,3'-diyl bis(3,4,5-trihydroxybenzoate)

  • Molecular FormulaC44H34O22
  • Average mass914.728 Da
  • Monoisotopic mass914.154175 Da
  • ChemSpider ID35014447

More details:

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

5,5',7,7'-Tetrahydroxy-2,2'-bis(3,4,5-trihydroxyphenyl)-3,3',4,4'-tetrahydro-2H,2'H-4,8'-bichromen-3,3'-diyl-bis(3,4,5-trihydroxybenzoat) [German] [ACD/IUPAC Name]
5,5',7,7'-Tetrahydroxy-2,2'-bis(3,4,5-trihydroxyphenyl)-3,3',4,4'-tetrahydro-2H,2'H-4,8'-bichromene-3,3'-diyl bis(3,4,5-trihydroxybenzoate) [ACD/IUPAC Name]
Benzoic acid, 3,4,5-trihydroxy-, 3,3',4,4'-tetrahydro-5,5',7,7'-tetrahydroxy-2,2'-bis(3,4,5-trihydroxyphenyl)[4,8'-bi-2H-1-benzopyran]-3,3'-diyl ester [ACD/Index Name]
Bis(3,4,5-trihydroxybenzoate) de 5,5',7,7'-tétrahydroxy-2,2'-bis(3,4,5-trihydroxyphényl)-3,3',4,4'-tétrahydro-2H,2'H-4,8'-bichromène-3,3'-diyle [French] [ACD/IUPAC Name]
3,3'-Digalloylprodelphinidin B2
3-O-Galloylepigallocatechin-(4β->8)-epigallocatechin-3-O-gallate
8-[5,7-dihydroxy-3-(3,4,5-trihydroxybenzoyloxy)-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-yl]-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate
Rhodisin

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

Density: 2.1±0.1 g/cm3
Boiling Point: 1276.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 197.6±3.0 kJ/mol
Flash Point: 384.7±27.8 °C
Index of Refraction: 1.955
Molar Refractivity: 214.8±0.4 cm3
#H bond acceptors: 22
#H bond donors: 16
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: 3.45
ACD/LogD (pH 5.5): 3.06
ACD/BCF (pH 5.5): 123.46
ACD/KOC (pH 5.5): 1092.36
ACD/LogD (pH 7.4): 3.03
ACD/BCF (pH 7.4): 117.14
ACD/KOC (pH 7.4): 1036.44
Polar Surface Area: 395 Å2
Polarizability: 85.2±0.5 10-24cm3
Surface Tension: 194.0±5.0 dyne/cm
Molar Volume: 443.2±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement