ChemSpider 2D Image | (3beta,9beta,22S)-3,22-Dihydroxy-9,19-cyclolanost-24-en-23-one | C30H48O3

(3β,9β,22S)-3,22-Dihydroxy-9,19-cyclolanost-24-en-23-one

  • Molecular FormulaC30H48O3
  • Average mass456.700 Da
  • Monoisotopic mass456.360352 Da
  • ChemSpider ID29416826

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(3β,9β,22S)-3,22-Dihydroxy-9,19-cyclolanost-24-en-23-on [German] [ACD/IUPAC Name]
(3β,9β,22S)-3,22-Dihydroxy-9,19-cyclolanost-24-en-23-one [ACD/IUPAC Name]
(3β,9β,22S)-3,22-Dihydroxy-9,19-cyclolanost-24-én-23-one [French] [ACD/IUPAC Name]
9,19-Cyclolanost-24-en-23-one, 3,22-dihydroxy-, (3β,9β,22S)- [ACD/Index Name]
3β,22α-Dihydroxy-5α-cycloartane-24-ene-23-one
Perviridisinol A

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

Density: 1.1±0.1 g/cm3
Boiling Point: 562.6±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.5 mmHg at 25°C
Enthalpy of Vaporization: 97.2±6.0 kJ/mol
Flash Point: 308.1±19.7 °C
Index of Refraction: 1.555
Molar Refractivity: 133.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 7.41
ACD/LogD (pH 5.5): 6.55
ACD/BCF (pH 5.5): 56466.70
ACD/KOC (pH 5.5): 87682.81
ACD/LogD (pH 7.4): 6.55
ACD/BCF (pH 7.4): 56466.58
ACD/KOC (pH 7.4): 87682.63
Polar Surface Area: 58 Å2
Polarizability: 52.9±0.5 10-24cm3
Surface Tension: 45.0±5.0 dyne/cm
Molar Volume: 415.7±5.0 cm3

Click to predict properties on the Chemicalize site


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