ChemSpider 2D Image | (1Z)-1-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-1,6-heptadien-3-one | C16H24O

(1Z)-1-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-1,6-heptadien-3-one

  • Molecular FormulaC16H24O
  • Average mass232.361 Da
  • Monoisotopic mass232.182709 Da
  • ChemSpider ID21427592

  • Double-bond stereo - Double-bond stereo

More details:

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

(1Z)-1-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-1,6-heptadien-3-on [German] [ACD/IUPAC Name]
(1Z)-1-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-1,6-heptadien-3-one [ACD/IUPAC Name]
(1Z)-1-(2,6,6-Triméthyl-2-cyclohexén-1-yl)-1,6-heptadién-3-one [French] [ACD/IUPAC Name]
1,6-Heptadien-3-one, 1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (1Z)- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 313.4±41.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.4±3.0 kJ/mol
Flash Point: 137.6±20.8 °C
Index of Refraction: 1.514
Molar Refractivity: 75.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.14
ACD/LogD (pH 5.5): 4.67
ACD/BCF (pH 5.5): 2083.95
ACD/KOC (pH 5.5): 8265.26
ACD/LogD (pH 7.4): 4.67
ACD/BCF (pH 7.4): 2083.95
ACD/KOC (pH 7.4): 8265.26
Polar Surface Area: 17 Å2
Polarizability: 29.9±0.5 10-24cm3
Surface Tension: 33.4±3.0 dyne/cm
Molar Volume: 250.3±3.0 cm3

Click to predict properties on the Chemicalize site


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