Found 4 results

Search term: UGKZRBNOJJLIPK (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-[(2S,3R,4S,5S)-4-Ethyl-1,3,5,10-tetramethyl-7,8-dioxatricyclo[4.2.2.0~2,5~]dec-9-en-3-yl]-6-methoxy-3,5-dimethyl-4H-pyran-4-one | C22H30O5

2-[(2S,3R,4S,5S)-4-Ethyl-1,3,5,10-tetramethyl-7,8-dioxatricyclo[4.2.2.02,5]dec-9-en-3-yl]-6-methoxy-3,5-dimethyl-4H-pyran-4-one

  • Molecular FormulaC22H30O5
  • Average mass374.471 Da
  • Monoisotopic mass374.209320 Da
  • ChemSpider ID75552048

  • defined stereocentres - 4 of 6 defined stereocentres

More details:

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

2-[(2S,3R,4S,5S)-4-Ethyl-1,3,5,10-tetramethyl-7,8-dioxatricyclo[4.2.2.02,5]dec-9-en-3-yl]-6-methoxy-3,5-dimethyl-4H-pyran-4-on [German] [ACD/IUPAC Name]
2-[(2S,3R,4S,5S)-4-Ethyl-1,3,5,10-tetramethyl-7,8-dioxatricyclo[4.2.2.02,5]dec-9-en-3-yl]-6-methoxy-3,5-dimethyl-4H-pyran-4-one [ACD/IUPAC Name]
2-[(2S,3R,4S,5S)-4-Éthyl-1,3,5,10-tétraméthyl-7,8-dioxatricyclo[4.2.2.02,5]déc-9-én-3-yl]-6-méthoxy-3,5-diméthyl-4H-pyran-4-one [French] [ACD/IUPAC Name]
4H-Pyran-4-one, 2-[(2S,3R,4S,5S)-4-ethyl-1,3,5,10-tetramethyl-7,8-dioxatricyclo[4.2.2.02,5]dec-9-en-3-yl]-6-methoxy-3,5-dimethyl- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 460.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.2±3.0 kJ/mol
Flash Point: 198.6±28.8 °C
Index of Refraction: 1.550
Molar Refractivity: 101.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.71
ACD/LogD (pH 5.5): 4.52
ACD/BCF (pH 5.5): 1596.37
ACD/KOC (pH 5.5): 6829.69
ACD/LogD (pH 7.4): 4.52
ACD/BCF (pH 7.4): 1596.37
ACD/KOC (pH 7.4): 6829.69
Polar Surface Area: 54 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 41.3±5.0 dyne/cm
Molar Volume: 318.3±5.0 cm3

Click to predict properties on the Chemicalize site


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