ChemSpider 2D Image | 2-[(3-Ethynylphenyl)ethynyl]-3-furoic acid | C15H8O3

2-[(3-Ethynylphenyl)ethynyl]-3-furoic acid

  • Molecular FormulaC15H8O3
  • Average mass236.222 Da
  • Monoisotopic mass236.047348 Da
  • ChemSpider ID90796327

More details:

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

2-[(3-Ethinylphenyl)ethinyl]-3-furoesäure [German] [ACD/IUPAC Name]
2-[(3-Ethynylphenyl)ethynyl]-3-furoic acid [ACD/IUPAC Name]
3-Furancarboxylic acid, 2-[2-(3-ethynylphenyl)ethynyl]- [ACD/Index Name]
Acide 2-[(3-éthynylphényl)éthynyl]-3-furoïque [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 438.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.3±3.0 kJ/mol
Flash Point: 218.9±27.3 °C
Index of Refraction: 1.652
Molar Refractivity: 64.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.77
ACD/LogD (pH 5.5): 2.00
ACD/BCF (pH 5.5): 7.16
ACD/KOC (pH 5.5): 43.64
ACD/LogD (pH 7.4): 0.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.52
Polar Surface Area: 50 Å2
Polarizability: 25.6±0.5 10-24cm3
Surface Tension: 68.9±5.0 dyne/cm
Molar Volume: 176.5±5.0 cm3

Click to predict properties on the Chemicalize site


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