ChemSpider 2D Image | 4-(2-Propyn-1-yloxy)-1-benzothiophene | C11H8OS

4-(2-Propyn-1-yloxy)-1-benzothiophene

  • Molecular FormulaC11H8OS
  • Average mass188.246 Da
  • Monoisotopic mass188.029587 Da
  • ChemSpider ID30909711

More details:

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

4-(2-Propin-1-yloxy)-1-benzothiophen [German] [ACD/IUPAC Name]
4-(2-Propyn-1-yloxy)-1-benzothiophene [ACD/IUPAC Name]
4-(2-Propyn-1-yloxy)-1-benzothiophène [French] [ACD/IUPAC Name]
Benzo[b]thiophene, 4-(2-propyn-1-yloxy)- [ACD/Index Name]
20009-52-3 [RN]
4-(PROP-2-YN-1-YLOXY)-1-BENZOTHIOPHENE
benzo[b]thiophene,4-(2-propyn-1-yloxy)-
benzothiophene,4-(2-propyn-1-yloxy)-
MFCD27992800

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

Density: 1.2±0.1 g/cm3
Boiling Point: 320.6±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 54.0±3.0 kJ/mol
Flash Point: 147.7±22.3 °C
Index of Refraction: 1.652
Molar Refractivity: 56.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.33
ACD/LogD (pH 5.5): 3.33
ACD/BCF (pH 5.5): 200.17
ACD/KOC (pH 5.5): 1545.05
ACD/LogD (pH 7.4): 3.33
ACD/BCF (pH 7.4): 200.17
ACD/KOC (pH 7.4): 1545.05
Polar Surface Area: 37 Å2
Polarizability: 22.3±0.5 10-24cm3
Surface Tension: 50.2±3.0 dyne/cm
Molar Volume: 153.8±3.0 cm3

Click to predict properties on the Chemicalize site


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