ChemSpider 2D Image | (4E)-1-(3,4-Dimethoxyphenyl)-4-dodecen-3-one | C20H30O3

(4E)-1-(3,4-Dimethoxyphenyl)-4-dodecen-3-one

  • Molecular FormulaC20H30O3
  • Average mass318.450 Da
  • Monoisotopic mass318.219482 Da
  • ChemSpider ID30776809
  • Double-bond stereo - Double-bond stereo


More details:






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

(4E)-1-(3,4-Dimethoxyphenyl)-4-dodecen-3-on [German] [ACD/IUPAC Name]
(4E)-1-(3,4-Dimethoxyphenyl)-4-dodecen-3-one [ACD/IUPAC Name]
(4E)-1-(3,4-Diméthoxyphényl)-4-dodécén-3-one [French] [ACD/IUPAC Name]
4-Dodecen-3-one, 1-(3,4-dimethoxyphenyl)-, (4E)- [ACD/Index Name]
863780-79-4 [RN]
(4E)-1-(3,4-dimethoxyphenyl)dodec-4-en-3-one
1-(3,4-Dimethoxyphenyl)-4-dodecen-3-one
Methyl [8]-Shogaol

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

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

Density: 1.0±0.1 g/cm3
Boiling Point: 438.2±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.5±3.0 kJ/mol
Flash Point: 210.7±12.4 °C
Index of Refraction: 1.498
Molar Refractivity: 95.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 5.68
ACD/LogD (pH 5.5): 5.76
ACD/BCF (pH 5.5): 13931.94
ACD/KOC (pH 5.5): 32201.13
ACD/LogD (pH 7.4): 5.76
ACD/BCF (pH 7.4): 13931.94
ACD/KOC (pH 7.4): 32201.13
Polar Surface Area: 36 Å2
Polarizability: 37.9±0.5 10-24cm3
Surface Tension: 34.0±3.0 dyne/cm
Molar Volume: 326.1±3.0 cm3

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