ChemSpider 2D Image | (1Z)-1-[(Butylsulfanyl)methylene]-3-methyl-2-methylenecyclohexane | C13H22S

(1Z)-1-[(Butylsulfanyl)methylene]-3-methyl-2-methylenecyclohexane

  • Molecular FormulaC13H22S
  • Average mass210.379 Da
  • Monoisotopic mass210.144226 Da
  • ChemSpider ID34018836

  • Double-bond stereo - Double-bond stereo

More details:

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

(1Z)-1-[(Butylsulfanyl)methylen]-3-methyl-2-methylencyclohexan [German] [ACD/IUPAC Name]
(1Z)-1-[(Butylsulfanyl)methylene]-3-methyl-2-methylenecyclohexane [ACD/IUPAC Name]
(1Z)-1-[(Butylsulfanyl)méthylène]-3-méthyl-2-méthylènecyclohexane [French] [ACD/IUPAC Name]
Cyclohexane, 1-[(butylthio)methylene]-3-methyl-2-methylene-, (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: 304.4±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.3±3.0 kJ/mol
Flash Point: 128.0±15.9 °C
Index of Refraction: 1.504
Molar Refractivity: 67.4±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.38
ACD/LogD (pH 5.5): 4.95
ACD/BCF (pH 5.5): 3372.11
ACD/KOC (pH 5.5): 11664.49
ACD/LogD (pH 7.4): 4.95
ACD/BCF (pH 7.4): 3372.11
ACD/KOC (pH 7.4): 11664.49
Polar Surface Area: 25 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 31.9±5.0 dyne/cm
Molar Volume: 227.5±5.0 cm3

Click to predict properties on the Chemicalize site


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