ChemSpider 2D Image | 1,5,9,11,14-Pentahydroxy-3-methyl-8,13-dioxo-5,6,8,13-tetrahydrobenzo[a]tetracene-2-carboxylic acid | C24H16O9

1,5,9,11,14-Pentahydroxy-3-methyl-8,13-dioxo-5,6,8,13-tetrahydrobenzo[a]tetracene-2-carboxylic acid

  • Molecular FormulaC24H16O9
  • Average mass448.378 Da
  • Monoisotopic mass448.079437 Da
  • ChemSpider ID57260745

More details:

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

1,5,9,11,14-Pentahydroxy-3-methyl-8,13-dioxo-5,6,8,13-tetrahydrobenzo[a]tetracen-2-carbonsäure [German] [ACD/IUPAC Name]
1,5,9,11,14-Pentahydroxy-3-methyl-8,13-dioxo-5,6,8,13-tetrahydrobenzo[a]tetracene-2-carboxylic acid [ACD/IUPAC Name]
Acide 1,5,9,11,14-pentahydroxy-3-méthyl-8,13-dioxo-5,6,8,13-tétrahydrobenzo[a]tétracène-2-carboxylique [French] [ACD/IUPAC Name]
Benzo[a]naphthacene-2-carboxylic acid, 5,6,8,13-tetrahydro-1,5,9,11,14-pentahydroxy-3-methyl-8,13-dioxo- [ACD/Index Name]
141869-53-6 [RN]
Pradimicin Q

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

Density: 1.8±0.1 g/cm3
Boiling Point: 862.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 131.3±3.0 kJ/mol
Flash Point: 489.3±30.8 °C
Index of Refraction: 1.826
Molar Refractivity: 111.7±0.3 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 2
ACD/LogP: 6.03
ACD/LogD (pH 5.5): 2.18
ACD/BCF (pH 5.5): 4.16
ACD/KOC (pH 5.5): 10.61
ACD/LogD (pH 7.4): 0.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 173 Å2
Polarizability: 44.3±0.5 10-24cm3
Surface Tension: 111.1±3.0 dyne/cm
Molar Volume: 255.2±3.0 cm3

Click to predict properties on the Chemicalize site


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