ChemSpider 2D Image | 3-(3-Ethynylphenyl)thiophene | C12H8S

3-(3-Ethynylphenyl)thiophene

  • Molecular FormulaC12H8S
  • Average mass184.257 Da
  • Monoisotopic mass184.034668 Da
  • ChemSpider ID60848232

More details:

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

3-(3-Ethinylphenyl)thiophen [German] [ACD/IUPAC Name]
3-(3-Ethynylphenyl)thiophene [ACD/IUPAC Name]
3-(3-Éthynylphényl)thiophène [French] [ACD/IUPAC Name]
Thiophene, 3-(3-ethynylphenyl)- [ACD/Index Name]
1025056-01-2 [RN]
MFCD23132486

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

Density: 1.2±0.1 g/cm3
Boiling Point: 283.0±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 50.1±3.0 kJ/mol
Flash Point: 91.3±8.8 °C
Index of Refraction: 1.637
Molar Refractivity: 56.7±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.84
ACD/LogD (pH 5.5): 3.79
ACD/BCF (pH 5.5): 448.21
ACD/KOC (pH 5.5): 2751.29
ACD/LogD (pH 7.4): 3.79
ACD/BCF (pH 7.4): 448.21
ACD/KOC (pH 7.4): 2751.29
Polar Surface Area: 28 Å2
Polarizability: 22.5±0.5 10-24cm3
Surface Tension: 50.1±5.0 dyne/cm
Molar Volume: 157.9±5.0 cm3

Click to predict properties on the Chemicalize site


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