ChemSpider 2D Image | 2,2',5,5'-Tetrahydroxy-8,8',10,10'-tetramethoxy-2,2'-dimethyl-2,2',3,3'-tetrahydro-4H,4'H-6,9'-bibenzo[h]chromene-4,4'-dione | C32H30O12

2,2',5,5'-Tetrahydroxy-8,8',10,10'-tetramethoxy-2,2'-dimethyl-2,2',3,3'-tetrahydro-4H,4'H-6,9'-bibenzo[h]chromene-4,4'-dione

  • Molecular FormulaC32H30O12
  • Average mass606.573 Da
  • Monoisotopic mass606.173706 Da
  • ChemSpider ID17284261

More details:

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

[6,9'-Bi-2H-naphtho[1,2-b]pyran]-4,4'(3H,3'H)-dione, 2,2',5,5'-tetrahydroxy-8,8',10,10'-tetramethoxy-2,2'-dimethyl- [ACD/Index Name]
2,2',5,5'-Tetrahydroxy-8,8',10,10'-tetramethoxy-2,2'-dimethyl-2,2',3,3'-tetrahydro-4H,4'H-6,9'-bibenzo[h]chromen-4,4'-dion [German] [ACD/IUPAC Name]
2,2',5,5'-Tetrahydroxy-8,8',10,10'-tetramethoxy-2,2'-dimethyl-2,2',3,3'-tetrahydro-4H,4'H-6,9'-bibenzo[h]chromene-4,4'-dione [ACD/IUPAC Name]
2,2',5,5'-Tétrahydroxy-8,8',10,10'-tétraméthoxy-2,2'-diméthyl-2,2',3,3'-tétrahydro-4H,4'H-6,9'-bibenzo[h]chromène-4,4'-dione [French] [ACD/IUPAC Name]
Nigerasperone B

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

Density: 1.5±0.1 g/cm3
Boiling Point: 817.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 124.6±3.0 kJ/mol
Flash Point: 265.7±27.8 °C
Index of Refraction: 1.681
Molar Refractivity: 157.2±0.3 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 4.06
ACD/LogD (pH 5.5): 3.60
ACD/BCF (pH 5.5): 300.08
ACD/KOC (pH 5.5): 1914.54
ACD/LogD (pH 7.4): 2.10
ACD/BCF (pH 7.4): 9.55
ACD/KOC (pH 7.4): 60.95
Polar Surface Area: 170 Å2
Polarizability: 62.3±0.5 10-24cm3
Surface Tension: 66.1±3.0 dyne/cm
Molar Volume: 415.4±3.0 cm3

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