ChemSpider 2D Image | 3-(Phenylethynyl)-1-benzofuran-5-carbaldehyde | C17H10O2

3-(Phenylethynyl)-1-benzofuran-5-carbaldehyde

  • Molecular FormulaC17H10O2
  • Average mass246.260 Da
  • Monoisotopic mass246.068085 Da
  • ChemSpider ID28570667

More details:

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

3-(2-Phenylethynyl)-5-benzofurancarboxaldehyde
3-(Phenylethinyl)-1-benzofuran-5-carbaldehyd [German] [ACD/IUPAC Name]
3-(Phenylethynyl)-1-benzofuran-5-carbaldehyde [ACD/IUPAC Name]
3-(Phényléthynyl)-1-benzofurane-5-carbaldéhyde [French] [ACD/IUPAC Name]
5-Benzofurancarboxaldehyde, 3-(2-phenylethynyl)- [ACD/Index Name]
648449-51-8 [RN]
3-(2-phenylethynyl)benzofuran-5-carbaldehyde
3-(Phenylethynyl)benzofuran-5-carbaldehyde
5-BENZOFURANCARBOXALDEHYDE, 3-(PHENYLETHYNYL)-

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

Density: 1.3±0.1 g/cm3
Boiling Point: 424.2±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.9±3.0 kJ/mol
Flash Point: 205.2±15.9 °C
Index of Refraction: 1.678
Molar Refractivity: 73.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.65
ACD/LogD (pH 5.5): 4.23
ACD/BCF (pH 5.5): 966.87
ACD/KOC (pH 5.5): 4770.09
ACD/LogD (pH 7.4): 4.23
ACD/BCF (pH 7.4): 966.87
ACD/KOC (pH 7.4): 4770.09
Polar Surface Area: 30 Å2
Polarizability: 29.2±0.5 10-24cm3
Surface Tension: 59.1±5.0 dyne/cm
Molar Volume: 195.6±5.0 cm3

Click to predict properties on the Chemicalize site


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