ChemSpider 2D Image | 4-(3,5-Diethynylphenyl)-2-methylene-3-butynal | C15H8O

4-(3,5-Diethynylphenyl)-2-methylene-3-butynal

  • Molecular FormulaC15H8O
  • Average mass204.223 Da
  • Monoisotopic mass204.057510 Da
  • ChemSpider ID84140833

More details:

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

3-Butynal, 4-(3,5-diethynylphenyl)-2-methylene- [ACD/Index Name]
4-(3,5-Diethinylphenyl)-2-methylen-3-butinal [German] [ACD/IUPAC Name]
4-(3,5-Diethynylphenyl)-2-methylene-3-butynal [ACD/IUPAC Name]
4-(3,5-Diéthynylphényl)-2-méthylène-3-butynal [French] [ACD/IUPAC 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: 394.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.4±3.0 kJ/mol
Flash Point: 175.2±22.8 °C
Index of Refraction: 1.594
Molar Refractivity: 61.9±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.54
ACD/LogD (pH 5.5): 2.96
ACD/BCF (pH 5.5): 105.10
ACD/KOC (pH 5.5): 974.25
ACD/LogD (pH 7.4): 2.96
ACD/BCF (pH 7.4): 105.10
ACD/KOC (pH 7.4): 974.25
Polar Surface Area: 17 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 52.5±5.0 dyne/cm
Molar Volume: 182.4±5.0 cm3

Click to predict properties on the Chemicalize site


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