ChemSpider 2D Image | astrogorgol F | C27H42O2

astrogorgol F

  • Molecular FormulaC27H42O2
  • Average mass398.621 Da
  • Monoisotopic mass398.318481 Da
  • ChemSpider ID27025783

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(9β,22E)-9,10-Secocholesta-1(10),2,4,22-tetraen-3,9-diol [German] [ACD/IUPAC Name]
(9β,22E)-9,10-Secocholesta-1(10),2,4,22-tetraene-3,9-diol [ACD/IUPAC Name]
(9β,22E)-9,10-Sécocholesta-1(10),2,4,22-tétraène-3,9-diol [French] [ACD/IUPAC Name]
1H-Inden-5-ol, 1-[(1R,2E)-1,5-dimethyl-2-hexen-1-yl]octahydro-4-[2-(5-hydroxy-2-methylphenyl)ethyl]-7a-methyl-, (1R,3aS,4S,5S,7aR)- [ACD/Index Name]
astrogorgol F

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

Density: 1.0±0.1 g/cm3
Boiling Point: 522.1±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.7±3.0 kJ/mol
Flash Point: 218.7±19.2 °C
Index of Refraction: 1.538
Molar Refractivity: 123.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 8.32
ACD/LogD (pH 5.5): 7.36
ACD/BCF (pH 5.5): 230153.53
ACD/KOC (pH 5.5): 239720.64
ACD/LogD (pH 7.4): 7.36
ACD/BCF (pH 7.4): 229897.17
ACD/KOC (pH 7.4): 239453.64
Polar Surface Area: 40 Å2
Polarizability: 48.9±0.5 10-24cm3
Surface Tension: 39.6±3.0 dyne/cm
Molar Volume: 394.0±3.0 cm3

Click to predict properties on the Chemicalize site


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