ChemSpider 2D Image | (5beta,10alpha)-15-Hydroxyabieta-8(14),9(11),12-trien-19-oic acid | C20H28O3

(5β,10α)-15-Hydroxyabieta-8(14),9(11),12-trien-19-oic acid

  • Molecular FormulaC20H28O3
  • Average mass316.435 Da
  • Monoisotopic mass316.203857 Da
  • ChemSpider ID82964996

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(5β,10α)-15-Hydroxyabieta-8(14),9(11),12-trien-19-oic acid [ACD/IUPAC Name]
(5β,10α)-15-Hydroxyabieta-8(14),9(11),12-trien-19-säure [German] [ACD/IUPAC Name]
1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,9,10,10a-octahydro-7-(1-hydroxy-1-methylethyl)-1,4a-dimethyl-, (1S,4aR,10aS)- [ACD/Index Name]
Acide (5β,10α)-15-hydroxyabiéta-8(14),9(11),12-trién-19-oïque [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 463.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.4±3.0 kJ/mol
Flash Point: 248.2±25.2 °C
Index of Refraction: 1.554
Molar Refractivity: 90.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.52
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 170.60
ACD/KOC (pH 5.5): 765.02
ACD/LogD (pH 7.4): 1.72
ACD/BCF (pH 7.4): 2.69
ACD/KOC (pH 7.4): 12.06
Polar Surface Area: 58 Å2
Polarizability: 35.7±0.5 10-24cm3
Surface Tension: 44.8±3.0 dyne/cm
Molar Volume: 281.3±3.0 cm3

Click to predict properties on the Chemicalize site


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