ChemSpider 2D Image | 2-Ethynyl-5-(1,5-hexadiyn-1-yl)thiophene | C12H8S

2-Ethynyl-5-(1,5-hexadiyn-1-yl)thiophene

  • Molecular FormulaC12H8S
  • Average mass184.257 Da
  • Monoisotopic mass184.034668 Da
  • ChemSpider ID85338254

More details:

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

2-Ethinyl-5-(1,5-hexadiin-1-yl)thiophen [German] [ACD/IUPAC Name]
2-Ethynyl-5-(1,5-hexadiyn-1-yl)thiophene [ACD/IUPAC Name]
2-Éthynyl-5-(1,5-hexadiyn-1-yl)thiophène [French] [ACD/IUPAC Name]
Thiophene, 2-ethynyl-5-(1,5-hexadiyn-1-yl)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 311.5±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.0±3.0 kJ/mol
Flash Point: 104.8±12.7 °C
Index of Refraction: 1.592
Molar Refractivity: 55.6±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.69
ACD/LogD (pH 5.5): 3.24
ACD/BCF (pH 5.5): 171.07
ACD/KOC (pH 5.5): 1380.77
ACD/LogD (pH 7.4): 3.24
ACD/BCF (pH 7.4): 171.07
ACD/KOC (pH 7.4): 1380.77
Polar Surface Area: 28 Å2
Polarizability: 22.0±0.5 10-24cm3
Surface Tension: 53.1±5.0 dyne/cm
Molar Volume: 164.2±5.0 cm3

Click to predict properties on the Chemicalize site


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