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Search term: YZXINJQTAMWFKM (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1-Methoxy-3a,5,5,8-tetramethyldecahydro-8bH-cyclopenta[de]isochromene-4,6,8b-triol | C16H28O5

1-Methoxy-3a,5,5,8-tetramethyldecahydro-8bH-cyclopenta[de]isochromene-4,6,8b-triol

  • Molecular FormulaC16H28O5
  • Average mass300.391 Da
  • Monoisotopic mass300.193665 Da
  • ChemSpider ID28282666

More details:

Featured data source
Natural Product Updates

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

1-Methoxy-3a,5,5,8-tetramethyldecahydro-8bH-cyclopenta[de]isochromen-4,6,8b-triol [German] [ACD/IUPAC Name]
1-Methoxy-3a,5,5,8-tetramethyldecahydro-8bH-cyclopenta[de]isochromene-4,6,8b-triol [ACD/IUPAC Name]
1-Méthoxy-3a,5,5,8-tétraméthyldécahydro-8bH-cyclopenta[de]isochromène-4,6,8b-triol [French] [ACD/IUPAC Name]
8bH-Indeno[1,7-cd]pyran-4,6,8b-triol, decahydro-1-methoxy-3a,5,5,8-tetramethyl- [ACD/Index Name]
7-hydroxy-10-methoxydeacetyldihydrobutyrdiol

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

Density: 1.2±0.1 g/cm3
Boiling Point: 442.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 80.8±6.0 kJ/mol
Flash Point: 221.4±28.7 °C
Index of Refraction: 1.548
Molar Refractivity: 78.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.44
ACD/LogD (pH 5.5): 0.65
ACD/BCF (pH 5.5): 1.84
ACD/KOC (pH 5.5): 53.83
ACD/LogD (pH 7.4): 0.65
ACD/BCF (pH 7.4): 1.84
ACD/KOC (pH 7.4): 53.83
Polar Surface Area: 79 Å2
Polarizability: 30.9±0.5 10-24cm3
Surface Tension: 49.3±5.0 dyne/cm
Molar Volume: 245.6±5.0 cm3

Click to predict properties on the Chemicalize site


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