ChemSpider 2D Image | 5-Ethynylisophthalaldehyde | C10H6O2

5-Ethynylisophthalaldehyde

  • Molecular FormulaC10H6O2
  • Average mass158.153 Da
  • Monoisotopic mass158.036774 Da
  • ChemSpider ID24190354

More details:

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

1,3-Benzenedicarboxaldehyde, 5-ethynyl- [ACD/Index Name]
5-Ethinylisophthalaldehyd [German] [ACD/IUPAC Name]
5-Éthynylisophtalaldéhyde [French] [ACD/IUPAC Name]
5-Ethynylisophthalaldehyde [ACD/IUPAC Name]
1,3-Benzenedicarboxaldehyde, 5-ethynyl- (9CI)
263746-70-9 [RN]
5-ethynylbenzene-1,3-dicarbaldehyde
MFCD18805376

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

Density: 1.2±0.1 g/cm3
Boiling Point: 307.8±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 54.8±3.0 kJ/mol
Flash Point: 115.1±23.5 °C
Index of Refraction: 1.565
Molar Refractivity: 43.8±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.52
ACD/LogD (pH 5.5): 1.69
ACD/BCF (pH 5.5): 11.29
ACD/KOC (pH 5.5): 197.34
ACD/LogD (pH 7.4): 1.69
ACD/BCF (pH 7.4): 11.29
ACD/KOC (pH 7.4): 197.34
Polar Surface Area: 34 Å2
Polarizability: 17.3±0.5 10-24cm3
Surface Tension: 50.1±5.0 dyne/cm
Molar Volume: 134.4±5.0 cm3

Click to predict properties on the Chemicalize site


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