ChemSpider 2D Image | 5-Ethynyl-2-benzofuran-1(3H)-one | C10H6O2

5-Ethynyl-2-benzofuran-1(3H)-one

  • Molecular FormulaC10H6O2
  • Average mass158.153 Da
  • Monoisotopic mass158.036774 Da
  • ChemSpider ID24603217

More details:

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

1(3H)-Isobenzofuranone, 5-ethynyl- [ACD/Index Name]
1179362-90-3 [RN]
5-Ethinyl-2-benzofuran-1(3H)-on [German] [ACD/IUPAC Name]
5-ethynyl-1,3-dihydro-2-benzofuran-1-one
5-Ethynyl-2-benzofuran-1(3H)-one [ACD/IUPAC Name]
5-Éthynyl-2-benzofuran-1(3H)-one [French] [ACD/IUPAC Name]
5-ETHYNYL-3H-2-BENZOFURAN-1-ONE
5-ethynyl-3h-isobenzo[b]furan-1-one
5-ETHYNYL-3H-ISOBENZOFURAN-1-ONE
5-Ethynylisobenzofuran-1(3H)-one
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 359.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.5±3.0 kJ/mol
Flash Point: 150.2±25.3 °C
Index of Refraction: 1.605
Molar Refractivity: 42.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.17
ACD/LogD (pH 5.5): 1.69
ACD/BCF (pH 5.5): 11.29
ACD/KOC (pH 5.5): 197.31
ACD/LogD (pH 7.4): 1.69
ACD/BCF (pH 7.4): 11.29
ACD/KOC (pH 7.4): 197.31
Polar Surface Area: 26 Å2
Polarizability: 17.0±0.5 10-24cm3
Surface Tension: 52.9±5.0 dyne/cm
Molar Volume: 124.5±5.0 cm3

Click to predict properties on the Chemicalize site


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