ChemSpider 2D Image | Acoragermacrone | C15H24O

Acoragermacrone

  • Molecular FormulaC15H24O
  • Average mass220.350 Da
  • Monoisotopic mass220.182709 Da
  • ChemSpider ID34994847
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(2E,6E,10S)-10-Isopropyl-3,7-dimethyl-2,6-cyclodecadien-1-on [German] [ACD/IUPAC Name]
(2E,6E,10S)-10-Isopropyl-3,7-dimethyl-2,6-cyclodecadien-1-one [ACD/IUPAC Name]
(2E,6E,10S)-10-Isopropyl-3,7-diméthyl-2,6-cyclodécadién-1-one [French] [ACD/IUPAC Name]
(2E,6E,10S)-3,7-Dimethyl-10-(1-methylethyl)-2,6-cyclodecadien-1-one
2,6-Cyclodecadien-1-one, 3,7-dimethyl-10-(1-methylethyl)-, (2E,6E,10S)- [ACD/Index Name]
50281-45-3 [RN]
Acoragermacrone
UNII:VTN7095NH0
UNII-VTN7095NH0

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 321.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.4±3.0 kJ/mol
Flash Point: 146.4±18.7 °C
Index of Refraction: 1.465
Molar Refractivity: 68.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.87
ACD/LogD (pH 5.5): 4.60
ACD/BCF (pH 5.5): 1832.50
ACD/KOC (pH 5.5): 7538.49
ACD/LogD (pH 7.4): 4.60
ACD/BCF (pH 7.4): 1832.50
ACD/KOC (pH 7.4): 7538.49
Polar Surface Area: 17 Å2
Polarizability: 27.2±0.5 10-24cm3
Surface Tension: 27.7±3.0 dyne/cm
Molar Volume: 248.6±3.0 cm3

Click to predict properties on the Chemicalize site






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