ChemSpider 2D Image | clostrubin | C25H18O6

clostrubin

  • Molecular FormulaC25H18O6
  • Average mass414.407 Da
  • Monoisotopic mass414.110352 Da
  • ChemSpider ID34485440

More details:

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

2-Acetyl-1,7,9,13-tetrahydroxy-5,11-dimethyl-8H-benzo[gh]tetraphen-8-on [German] [ACD/IUPAC Name]
2-Acetyl-1,7,9,13-tetrahydroxy-5,11-dimethyl-8H-benzo[gh]tetraphen-8-one [ACD/IUPAC Name]
2-Acétyl-1,7,9,13-tétrahydroxy-5,11-diméthyl-8H-benzo[gh]tétraphén-8-one [French] [ACD/IUPAC Name]
8H-Dibenz[a,de]anthracen-8-one, 2-acetyl-1,7,9,13-tetrahydroxy-5,11-dimethyl- [ACD/Index Name]
clostrubin

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

Density: 1.5±0.1 g/cm3
Boiling Point: 690.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.8±3.0 kJ/mol
Flash Point: 385.1±28.0 °C
Index of Refraction: 1.810
Molar Refractivity: 116.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 6.50
ACD/LogD (pH 5.5): 5.32
ACD/BCF (pH 5.5): 3991.55
ACD/KOC (pH 5.5): 7384.19
ACD/LogD (pH 7.4): 3.14
ACD/BCF (pH 7.4): 26.67
ACD/KOC (pH 7.4): 49.34
Polar Surface Area: 115 Å2
Polarizability: 46.3±0.5 10-24cm3
Surface Tension: 84.1±3.0 dyne/cm
Molar Volume: 270.9±3.0 cm3

Click to predict properties on the Chemicalize site


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