ChemSpider 2D Image | 1-(trans-4-Ethylcyclohexyl)-4-ethynylbenzene | C16H20

1-(trans-4-Ethylcyclohexyl)-4-ethynylbenzene

  • Molecular FormulaC16H20
  • Average mass212.330 Da
  • Monoisotopic mass212.156494 Da
  • ChemSpider ID27471671

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-(trans-4-Ethylcyclohexyl)-4-ethynylbenzene [ACD/IUPAC Name]
1-(trans-4-Éthylcyclohexyl)-4-éthynylbenzène [French] [ACD/IUPAC Name]
1-Ethinyl-4-(trans-4-ethylcyclohexyl)benzol [German] [ACD/IUPAC Name]
Benzene, 1-(trans-4-ethylcyclohexyl)-4-ethynyl- [ACD/Index Name]
1369510-20-2 [RN]
MFCD09751227
trans-1-(4-Ethylcyclohexyl)-4-ethynylbenzene
trans-4-(4-Ethylcyclohexyl)phenyl acetylene
Trans-4-(4-ethylcyclohexyl)-phenyl acetylene

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

Density: 1.0±0.1 g/cm3
Boiling Point: 304.6±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 52.3±0.8 kJ/mol
Flash Point: 131.6±16.2 °C
Index of Refraction: 1.534
Molar Refractivity: 68.8±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.94
ACD/LogD (pH 5.5): 5.22
ACD/BCF (pH 5.5): 5477.39
ACD/KOC (pH 5.5): 16506.81
ACD/LogD (pH 7.4): 5.22
ACD/BCF (pH 7.4): 5477.39
ACD/KOC (pH 7.4): 16506.81
Polar Surface Area: 0 Å2
Polarizability: 27.3±0.5 10-24cm3
Surface Tension: 37.8±5.0 dyne/cm
Molar Volume: 221.1±5.0 cm3

Click to predict properties on the Chemicalize site


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