ChemSpider 2D Image | (6S,7S)-6,7-Dihydroxy-1,6-dimethyl-6,7,8,9-tetrahydrophenanthro[1,2-b]furan-10,11-dione | C18H16O5

(6S,7S)-6,7-Dihydroxy-1,6-dimethyl-6,7,8,9-tetrahydrophenanthro[1,2-b]furan-10,11-dione

  • Molecular FormulaC18H16O5
  • Average mass312.317 Da
  • Monoisotopic mass312.099762 Da
  • ChemSpider ID82965575

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(6S,7S)-6,7-Dihydroxy-1,6-dimethyl-6,7,8,9-tetrahydrophenanthro[1,2-b]furan-10,11-dion [German] [ACD/IUPAC Name]
(6S,7S)-6,7-Dihydroxy-1,6-dimethyl-6,7,8,9-tetrahydrophenanthro[1,2-b]furan-10,11-dione [ACD/IUPAC Name]
(6S,7S)-6,7-Dihydroxy-1,6-diméthyl-6,7,8,9-tétrahydrophénanthro[1,2-b]furane-10,11-dione [French] [ACD/IUPAC Name]
Phenanthro[1,2-b]furan-10,11-dione, 6,7,8,9-tetrahydro-6,7-dihydroxy-1,6-dimethyl-, (6S,7S)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 561.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.8±3.0 kJ/mol
Flash Point: 293.4±30.1 °C
Index of Refraction: 1.661
Molar Refractivity: 80.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.25
ACD/LogD (pH 5.5): 2.14
ACD/BCF (pH 5.5): 25.04
ACD/KOC (pH 5.5): 348.91
ACD/LogD (pH 7.4): 2.14
ACD/BCF (pH 7.4): 25.04
ACD/KOC (pH 7.4): 348.91
Polar Surface Area: 88 Å2
Polarizability: 31.9±0.5 10-24cm3
Surface Tension: 67.9±3.0 dyne/cm
Molar Volume: 217.4±3.0 cm3

Click to predict properties on the Chemicalize site


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