ChemSpider 2D Image | 6-[(4E,6E,8E,11E)-4,6,8,10,12,14-Hexamethyl-13-oxo-4,6,8,11-heptadecatetraen-2-yl]-4-hydroxy-3,5-dimethyl-2H-pyran-2-one | C30H44O4

6-[(4E,6E,8E,11E)-4,6,8,10,12,14-Hexamethyl-13-oxo-4,6,8,11-heptadecatetraen-2-yl]-4-hydroxy-3,5-dimethyl-2H-pyran-2-one

  • Molecular FormulaC30H44O4
  • Average mass468.668 Da
  • Monoisotopic mass468.323975 Da
  • ChemSpider ID58196423

  • Double-bond stereo - Double-bond stereo

More details:

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

2H-Pyran-2-one, 6-[(3E,5E,7E,10E)-1,3,5,7,9,11,13-heptamethyl-12-oxo-3,5,7,10-hexadecatetraen-1-yl]-4-hydroxy-3,5-dimethyl- [ACD/Index Name]
6-[(4E,6E,8E,11E)-4,6,8,10,12,14-Hexamethyl-13-oxo-4,6,8,11-heptadecatetraen-2-yl]-4-hydroxy-3,5-dimethyl-2H-pyran-2-on [German] [ACD/IUPAC Name]
6-[(4E,6E,8E,11E)-4,6,8,10,12,14-Hexamethyl-13-oxo-4,6,8,11-heptadecatetraen-2-yl]-4-hydroxy-3,5-dimethyl-2H-pyran-2-one [ACD/IUPAC Name]
6-[(4E,6E,8E,11E)-4,6,8,10,12,14-Hexaméthyl-13-oxo-4,6,8,11-heptadécatétraén-2-yl]-4-hydroxy-3,5-diméthyl-2H-pyran-2-one [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 592.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.8 mmHg at 25°C
Enthalpy of Vaporization: 101.4±6.0 kJ/mol
Flash Point: 182.8±23.6 °C
Index of Refraction: 1.521
Molar Refractivity: 141.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 8.40
ACD/LogD (pH 5.5): 6.69
ACD/BCF (pH 5.5): 64711.19
ACD/KOC (pH 5.5): 86603.66
ACD/LogD (pH 7.4): 5.27
ACD/BCF (pH 7.4): 2501.94
ACD/KOC (pH 7.4): 3348.37
Polar Surface Area: 64 Å2
Polarizability: 55.9±0.5 10-24cm3
Surface Tension: 36.6±3.0 dyne/cm
Molar Volume: 463.3±3.0 cm3

Click to predict properties on the Chemicalize site


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