ChemSpider 2D Image | hortein | C20H12O6

hortein

  • Molecular FormulaC20H12O6
  • Average mass348.306 Da
  • Monoisotopic mass348.063385 Da
  • ChemSpider ID8535815

More details:

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

3,4,7,8-Tetrahydroxy-10,11-dihydrobenzo[j]fluoranthen-9,12-dion [German] [ACD/IUPAC Name]
3,4,7,8-Tetrahydroxy-10,11-dihydrobenzo[j]fluoranthene-9,12-dione [ACD/IUPAC Name]
3,4,7,8-Tétrahydroxy-10,11-dihydrobenzo[j]fluoranthène-9,12-dione [French] [ACD/IUPAC Name]
Benzo[j]fluoranthene-9,12-dione, 10,11-dihydro-3,4,7,8-tetrahydroxy- [ACD/Index Name]
hortein
2,3-dihydro-5,6,9,10-tetrahydroxy-benzo[j]fluoranthene-1,4-dione
346610-88-6 [RN]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL479132/

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

Density: 1.8±0.1 g/cm3
Boiling Point: 640.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.0±3.0 kJ/mol
Flash Point: 355.1±28.0 °C
Index of Refraction: 1.989
Molar Refractivity: 97.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.09
ACD/LogD (pH 5.5): 3.46
ACD/BCF (pH 5.5): 232.28
ACD/KOC (pH 5.5): 1574.35
ACD/LogD (pH 7.4): 2.10
ACD/BCF (pH 7.4): 10.17
ACD/KOC (pH 7.4): 68.95
Polar Surface Area: 115 Å2
Polarizability: 38.5±0.5 10-24cm3
Surface Tension: 122.2±3.0 dyne/cm
Molar Volume: 195.5±3.0 cm3

Click to predict properties on the Chemicalize site


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