Found 1 result

Search term: 78443471 (Found by CSID)
ChemSpider 2D Image | (3R,3aS,6R,6aS,7R)-3,7-Dihydroxy-6,8,8-trimethyl-1,3a,4,6,6a,7,8,9-octahydroazuleno[4,5-c]furan-5(3H)-one | C15H22O4

(3R,3aS,6R,6aS,7R)-3,7-Dihydroxy-6,8,8-trimethyl-1,3a,4,6,6a,7,8,9-octahydroazuleno[4,5-c]furan-5(3H)-one

  • Molecular FormulaC15H22O4
  • Average mass266.333 Da
  • Monoisotopic mass266.151794 Da
  • ChemSpider ID78443471

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(3R,3aS,6R,6aS,7R)-3,7-Dihydroxy-6,8,8-trimethyl-1,3a,4,6,6a,7,8,9-octahydroazuleno[4,5-c]furan-5(3H)-on [German] [ACD/IUPAC Name]
(3R,3aS,6R,6aS,7R)-3,7-Dihydroxy-6,8,8-trimethyl-1,3a,4,6,6a,7,8,9-octahydroazuleno[4,5-c]furan-5(3H)-one [ACD/IUPAC Name]
(3R,3aS,6R,6aS,7R)-3,7-Dihydroxy-6,8,8-triméthyl-1,3a,4,6,6a,7,8,9-octahydroazuléno[4,5-c]furan-5(3H)-one [French] [ACD/IUPAC Name]
Azuleno[4,5-c]furan-5(3H)-one, 1,3a,4,6,6a,7,8,9-octahydro-3,7-dihydroxy-6,8,8-trimethyl-, (3R,3aS,6R,6aS,7R)- [ACD/Index Name]
Ceriponol E

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

Density: 1.2±0.1 g/cm3
Boiling Point: 449.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 81.7±6.0 kJ/mol
Flash Point: 167.6±22.2 °C
Index of Refraction: 1.563
Molar Refractivity: 69.6±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.43
ACD/LogD (pH 5.5): 0.60
ACD/BCF (pH 5.5): 1.69
ACD/KOC (pH 5.5): 50.76
ACD/LogD (pH 7.4): 0.60
ACD/BCF (pH 7.4): 1.69
ACD/KOC (pH 7.4): 50.76
Polar Surface Area: 67 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 49.4±5.0 dyne/cm
Molar Volume: 214.3±5.0 cm3

Click to predict properties on the Chemicalize site


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