Found 11 results

Search term: CVAZWHZRZNYCOV (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 5-Hydroxy-4-(5-{2-[(1R,2R,4aS,8aR)-1,2,4a-trimethyl-5-methylenedecahydro-1-naphthalenyl]ethyl}-3,6-dihydro-2H-pyran-2-yl)-2(5H)-furanone | C25H36O4

5-Hydroxy-4-(5-{2-[(1R,2R,4aS,8aR)-1,2,4a-trimethyl-5-methylenedecahydro-1-naphthalenyl]ethyl}-3,6-dihydro-2H-pyran-2-yl)-2(5H)-furanone

  • Molecular FormulaC25H36O4
  • Average mass400.551 Da
  • Monoisotopic mass400.261353 Da
  • ChemSpider ID30771582

  • defined stereocentres - 3 of 6 defined stereocentres

More details:

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

2(5H)-Furanone, 4-[5-[2-[(1R,2R,4aS,8aR)-decahydro-1,2,4a-trimethyl-5-methylene-1-naphthalenyl]ethyl]-3,6-dihydro-2H-pyran-2-yl]-5-hydroxy- [ACD/Index Name]
5-Hydroxy-4-(5-{2-[(1R,2R,4aS,8aR)-1,2,4a-trimethyl-5-methylendecahydro-1-naphthalinyl]ethyl}-3,6-dihydro-2H-pyran-2-yl)-2(5H)-furanon [German] [ACD/IUPAC Name]
5-Hydroxy-4-(5-{2-[(1R,2R,4aS,8aR)-1,2,4a-triméthyl-5-méthylènedécahydro-1-naphtalényl]éthyl}-3,6-dihydro-2H-pyran-2-yl)-2(5H)-furanone [French] [ACD/IUPAC Name]
5-Hydroxy-4-(5-{2-[(1R,2R,4aS,8aR)-1,2,4a-trimethyl-5-methylenedecahydro-1-naphthalenyl]ethyl}-3,6-dihydro-2H-pyran-2-yl)-2(5H)-furanone [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 563.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.5 mmHg at 25°C
Enthalpy of Vaporization: 97.3±6.0 kJ/mol
Flash Point: 187.5±23.6 °C
Index of Refraction: 1.554
Molar Refractivity: 113.6±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.86
ACD/LogD (pH 5.5): 5.25
ACD/BCF (pH 5.5): 5757.11
ACD/KOC (pH 5.5): 17105.65
ACD/LogD (pH 7.4): 5.25
ACD/BCF (pH 7.4): 5731.96
ACD/KOC (pH 7.4): 17030.93
Polar Surface Area: 56 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 44.2±5.0 dyne/cm
Molar Volume: 354.5±5.0 cm3

Click to predict properties on the Chemicalize site


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