ChemSpider 2D Image | (1beta,7beta,12beta,14S)-1,7,12,14-Tetrahydroxykaur-16-en-15-one | C20H30O5

(1β,7β,12β,14S)-1,7,12,14-Tetrahydroxykaur-16-en-15-one

  • Molecular FormulaC20H30O5
  • Average mass350.449 Da
  • Monoisotopic mass350.209320 Da
  • ChemSpider ID82965595

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(1β,7β,12β,14S)-1,7,12,14-Tetrahydroxykaur-16-en-15-on [German] [ACD/IUPAC Name]
(1β,7β,12β,14S)-1,7,12,14-Tetrahydroxykaur-16-en-15-one [ACD/IUPAC Name]
(1β,7β,12β,14S)-1,7,12,14-Tétrahydroxykaur-16-én-15-one [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 558.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.4 mmHg at 25°C
Enthalpy of Vaporization: 96.6±6.0 kJ/mol
Flash Point: 305.8±26.6 °C
Index of Refraction: 1.600
Molar Refractivity: 92.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.13
ACD/LogD (pH 5.5): 1.22
ACD/BCF (pH 5.5): 4.95
ACD/KOC (pH 5.5): 109.33
ACD/LogD (pH 7.4): 1.22
ACD/BCF (pH 7.4): 4.95
ACD/KOC (pH 7.4): 109.33
Polar Surface Area: 98 Å2
Polarizability: 36.5±0.5 10-24cm3
Surface Tension: 58.9±5.0 dyne/cm
Molar Volume: 269.4±5.0 cm3

Click to predict properties on the Chemicalize site


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