ChemSpider 2D Image | (9beta,11alpha)-8,9,12-Trihydroxyaristol-1(10)-en-2-one | C15H22O4

(9β,11α)-8,9,12-Trihydroxyaristol-1(10)-en-2-one

  • Molecular FormulaC15H22O4
  • Average mass266.333 Da
  • Monoisotopic mass266.151794 Da
  • ChemSpider ID78441939

  • defined stereocentres - 6 of 7 defined stereocentres

More details:

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

(9β,11α)-8,9,12-Trihydroxyaristol-1(10)-en-2-on [German] [ACD/IUPAC Name]
(9β,11α)-8,9,12-Trihydroxyaristol-1(10)-en-2-one [ACD/IUPAC Name]
(9β,11α)-8,9,12-Trihydroxyaristol-1(10)-én-2-one [French] [ACD/IUPAC Name]
5H-Cyclopropa[a]naphthalen-5-one, 1,1a,2,3,6,7,7a,7b-octahydro-2,3-dihydroxy-1-(hydroxymethyl)-1,7,7a-trimethyl-, (1R,3R,7R,7aR)- [ACD/Index Name]
Rulepidatriol

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

Density: 1.3±0.1 g/cm3
Boiling Point: 440.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 80.6±6.0 kJ/mol
Flash Point: 234.5±25.2 °C
Index of Refraction: 1.591
Molar Refractivity: 69.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.38
ACD/LogD (pH 5.5): 0.50
ACD/BCF (pH 5.5): 1.42
ACD/KOC (pH 5.5): 44.80
ACD/LogD (pH 7.4): 0.50
ACD/BCF (pH 7.4): 1.42
ACD/KOC (pH 7.4): 44.80
Polar Surface Area: 78 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 56.3±5.0 dyne/cm
Molar Volume: 206.2±5.0 cm3

Click to predict properties on the Chemicalize site


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