ChemSpider 2D Image | (6aR,13aS,14dR,14eR)-6a,13a-Dihydroxy-1,8-bis(4-hydroxyphenyl)-6a,13a,14d,14e-tetrahydro-6,13-dioxatetraceno[2,1,12,11,10-mnopqra]tetracene-7,14-dione | C38H22O8

(6aR,13aS,14dR,14eR)-6a,13a-Dihydroxy-1,8-bis(4-hydroxyphenyl)-6a,13a,14d,14e-tetrahydro-6,13-dioxatetraceno[2,1,12,11,10-mnopqra]tetracene-7,14-dione

  • Molecular FormulaC38H22O8
  • Average mass606.576 Da
  • Monoisotopic mass606.131470 Da
  • ChemSpider ID113610711

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(6aR,13aS,14dR,14eR)-6a,13a-Dihydroxy-1,8-bis(4-hydroxyphenyl)-6a,13a,14d,14e-tetrahydro-6,13-dioxatetraceno[2,1,12,11,10-mnopqra]tetracen-7,14-dion [German] [ACD/IUPAC Name]
(6aR,13aS,14dR,14eR)-6a,13a-Dihydroxy-1,8-bis(4-hydroxyphenyl)-6a,13a,14d,14e-tetrahydro-6,13-dioxatetraceno[2,1,12,11,10-mnopqra]tetracene-7,14-dione [ACD/IUPAC Name]
(6aR,13aS,14dR,14eR)-6a,13a-Dihydroxy-1,8-bis(4-hydroxyphényl)-6a,13a,14d,14e-tétrahydro-6,13-dioxatétracéno[2,1,12,11,10-mnopqra]tétracène-7,14-dione [French] [ACD/IUPAC Name]
Naphtho[2',1',8':1,8,7][2]benzopyrano[5,4,3-cde]naphtho[8,1,2-hij][2]benzopyran-7,14-dione, 6a,13a,14d,14e-tetrahydro-6a,13a-dihydroxy-1,8-bis(4-hydroxyphenyl)-, (6aR,13aS,14dR,14eR)- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.876
Molar Refractivity: 166.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: 6.81
ACD/LogD (pH 5.5): 5.99
ACD/BCF (pH 5.5): 21039.21
ACD/KOC (pH 5.5): 43241.19
ACD/LogD (pH 7.4): 5.96
ACD/BCF (pH 7.4): 19601.43
ACD/KOC (pH 7.4): 40286.17
Polar Surface Area: 134 Å2
Polarizability: 66.0±0.5 10-24cm3
Surface Tension: 99.1±3.0 dyne/cm
Molar Volume: 364.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement