ChemSpider 2D Image | (3beta,13alpha)-3-Hydroxypimara-8,15-dien-2-one | C20H30O2

(3β,13α)-3-Hydroxypimara-8,15-dien-2-one

  • Molecular FormulaC20H30O2
  • Average mass302.451 Da
  • Monoisotopic mass302.224579 Da
  • ChemSpider ID40256586

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(3β,13α)-3-Hydroxypimara-8,15-dien-2-on [German] [ACD/IUPAC Name]
(3β,13α)-3-Hydroxypimara-8,15-dien-2-one [ACD/IUPAC Name]
(3β,13α)-3-Hydroxypimara-8,15-dién-2-one [French] [ACD/IUPAC Name]
3(2H)-Phenanthrenone, 7-ethenyl-1,4,4a,5,6,7,8,9,10,10a-decahydro-2-hydroxy-1,1,4a,7-tetramethyl-, (2R,4aS,7S,10aR)- [ACD/Index Name]
Isopimara-2-one-3-ol-8,15-diene

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

Density: 1.1±0.1 g/cm3
Boiling Point: 414.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 77.1±6.0 kJ/mol
Flash Point: 176.9±21.3 °C
Index of Refraction: 1.537
Molar Refractivity: 89.4±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.68
ACD/LogD (pH 5.5): 4.76
ACD/BCF (pH 5.5): 2430.59
ACD/KOC (pH 5.5): 9227.58
ACD/LogD (pH 7.4): 4.76
ACD/BCF (pH 7.4): 2430.58
ACD/KOC (pH 7.4): 9227.56
Polar Surface Area: 37 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 39.8±5.0 dyne/cm
Molar Volume: 286.3±5.0 cm3

Click to predict properties on the Chemicalize site


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