ChemSpider 2D Image | {(1Z,3E)-4-[(2-Methyl-2-propanyl)sulfanyl]-1,3-butadien-1-yl}cyclohexane | C14H24S

{(1Z,3E)-4-[(2-Methyl-2-propanyl)sulfanyl]-1,3-butadien-1-yl}cyclohexane

  • Molecular FormulaC14H24S
  • Average mass224.405 Da
  • Monoisotopic mass224.159866 Da
  • ChemSpider ID21418966

  • Double-bond stereo - Double-bond stereo

More details:

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

{(1Z,3E)-4-[(2-Methyl-2-propanyl)sulfanyl]-1,3-butadien-1-yl}cyclohexan [German] [ACD/IUPAC Name]
{(1Z,3E)-4-[(2-Methyl-2-propanyl)sulfanyl]-1,3-butadien-1-yl}cyclohexane [ACD/IUPAC Name]
{(1Z,3E)-4-[(2-Méthyl-2-propanyl)sulfanyl]-1,3-butadién-1-yl}cyclohexane [French] [ACD/IUPAC Name]
Cyclohexane, [(1Z,3E)-4-[(1,1-dimethylethyl)thio]-1,3-butadien-1-yl]- [ACD/Index 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: 319.9±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 53.9±3.0 kJ/mol
Flash Point: 136.7±15.9 °C
Index of Refraction: 1.555
Molar Refractivity: 74.6±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.39
ACD/LogD (pH 5.5): 5.27
ACD/BCF (pH 5.5): 5985.14
ACD/KOC (pH 5.5): 17588.21
ACD/LogD (pH 7.4): 5.27
ACD/BCF (pH 7.4): 5985.14
ACD/KOC (pH 7.4): 17588.21
Polar Surface Area: 25 Å2
Polarizability: 29.6±0.5 10-24cm3
Surface Tension: 34.8±3.0 dyne/cm
Molar Volume: 232.5±3.0 cm3

Click to predict properties on the Chemicalize site


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