ChemSpider 2D Image | 3'-(3,5-Dihydroxyphenyl)-4-[4-(3,5-dihydroxyphenyl)-2,5-bis(4-hydroxyphenyl)tetrahydro-3-furanyl]-2,2'-bis(4-hydroxyphenyl)-2,2',3,3'-tetrahydro-3,4'-bi-1-benzofuran-6,6'-diol | C56H44O13

3'-(3,5-Dihydroxyphenyl)-4-[4-(3,5-dihydroxyphenyl)-2,5-bis(4-hydroxyphenyl)tetrahydro-3-furanyl]-2,2'-bis(4-hydroxyphenyl)-2,2',3,3'-tetrahydro-3,4'-bi-1-benzofuran-6,6'-diol

  • Molecular FormulaC56H44O13
  • Average mass924.941 Da
  • Monoisotopic mass924.278198 Da
  • ChemSpider ID437473

More details:

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

[3,4'-Bibenzofuran]-6,6'-diol, 3'-(3,5-dihydroxyphenyl)-4-[4-(3,5-dihydroxyphenyl)tetrahydro-2,5-bis(4-hydroxyphenyl)-3-furanyl]-2,2',3,3'-tetrahydro-2,2'-bis(4-hydroxyphenyl)- [ACD/Index Name]
3'-(3,5-Dihydroxyphenyl)-4-[4-(3,5-dihydroxyphenyl)-2,5-bis(4-hydroxyphenyl)tetrahydro-3-furanyl]-2,2'-bis(4-hydroxyphenyl)-2,2',3,3'-tetrahydro-3,4'-bi-1-benzofuran-6,6'-diol [ACD/IUPAC Name]
3'-(3,5-Dihydroxyphenyl)-4-[4-(3,5-dihydroxyphenyl)-2,5-bis(4-hydroxyphenyl)tetrahydro-3-furanyl]-2,2'-bis(4-hydroxyphenyl)-2,2',3,3'-tetrahydro-3,4'-bi-1-benzofuran-6,6'-diol [German] [ACD/IUPAC Name]
3'-(3,5-Dihydroxyphényl)-4-[4-(3,5-dihydroxyphényl)-2,5-bis(4-hydroxyphényl)tétrahydro-3-furanyl]-2,2'-bis(4-hydroxyphényl)-2,2',3,3'-tétrahydro-3,4'-bi-1-benzofurane-6,6'-diol [French] [ACD/IUPAC Name]
124027-58-3 [RN]
Kobophenol A [Wiki]

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

AIDS160479 [DBID]
AIDS-160479 [DBID]
NSC631690 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.754
Molar Refractivity: 252.8±0.3 cm3
#H bond acceptors: 13
#H bond donors: 10
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 4
ACD/LogP: 6.59
ACD/LogD (pH 5.5): 6.62
ACD/BCF (pH 5.5): 62783.00
ACD/KOC (pH 5.5): 94533.96
ACD/LogD (pH 7.4): 6.61
ACD/BCF (pH 7.4): 62346.72
ACD/KOC (pH 7.4): 93877.05
Polar Surface Area: 230 Å2
Polarizability: 100.2±0.5 10-24cm3
Surface Tension: 82.8±3.0 dyne/cm
Molar Volume: 617.8±3.0 cm3

Click to predict properties on the Chemicalize site


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