ChemSpider 2D Image | 2,2',4,4',5,5'-Hexahydroxy-7,7'-bis(hydroxymethyl)-1,1'-bianthracene-9,9',10,10'-tetrone | C30H18O12

2,2',4,4',5,5'-Hexahydroxy-7,7'-bis(hydroxymethyl)-1,1'-bianthracene-9,9',10,10'-tetrone

  • Molecular FormulaC30H18O12
  • Average mass570.457 Da
  • Monoisotopic mass570.079834 Da
  • ChemSpider ID81367221

More details:

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

[1,1'-Bianthracene]-9,9',10,10'-tetrone, 2,2',4,4',5,5'-hexahydroxy-7,7'-bis(hydroxymethyl)- [ACD/Index Name]
2,2',4,4',5,5'-Hexahydroxy-7,7'-bis(hydroxymethyl)-1,1'-bianthracen-9,9',10,10'-tetron [German] [ACD/IUPAC Name]
2,2',4,4',5,5'-Hexahydroxy-7,7'-bis(hydroxymethyl)-1,1'-bianthracene-9,9',10,10'-tetrone [ACD/IUPAC Name]
2,2',4,4',5,5'-Hexahydroxy-7,7'-bis(hydroxyméthyl)-1,1'-bianthracène-9,9',10,10'-tétrone [French] [ACD/IUPAC Name]
2530-38-3 [RN]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 1061.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 162.8±3.0 kJ/mol
Flash Point: 609.2±30.8 °C
Index of Refraction: 1.853
Molar Refractivity: 139.9±0.3 cm3
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 4
ACD/LogP: 5.63
ACD/LogD (pH 5.5): 3.71
ACD/BCF (pH 5.5): 204.02
ACD/KOC (pH 5.5): 722.53
ACD/LogD (pH 7.4): -1.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 230 Å2
Polarizability: 55.4±0.5 10-24cm3
Surface Tension: 122.3±3.0 dyne/cm
Molar Volume: 312.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement