ChemSpider 2D Image | taraxasta-1,20(30)-dien-3-one | C30H46O

taraxasta-1,20(30)-dien-3-one

  • Molecular FormulaC30H46O
  • Average mass422.686 Da
  • Monoisotopic mass422.354858 Da
  • ChemSpider ID24775606

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(18α,19α)-Ursa-1,20(30)-dien-3-on [German] [ACD/IUPAC Name]
(18α,19α)-Ursa-1,20(30)-dien-3-one [ACD/IUPAC Name]
(18α,19α)-Ursa-1,20(30)-dién-3-one [French] [ACD/IUPAC Name]
taraxasta-1,20(30)-dien-3-one
Ursa-1,20(30)-dien-3-one, (18α,19α)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 489.9±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.6±3.0 kJ/mol
Flash Point: 258.1±14.0 °C
Index of Refraction: 1.539
Molar Refractivity: 130.2±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 10.17
ACD/LogD (pH 5.5): 9.45
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 3276307.75
ACD/LogD (pH 7.4): 9.45
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 3276307.75
Polar Surface Area: 17 Å2
Polarizability: 51.6±0.5 10-24cm3
Surface Tension: 38.2±5.0 dyne/cm
Molar Volume: 415.9±5.0 cm3

Click to predict properties on the Chemicalize site


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