ChemSpider 2D Image | 2-Ethynyl-3-quinolinecarbaldehyde | C12H7NO

2-Ethynyl-3-quinolinecarbaldehyde

  • Molecular FormulaC12H7NO
  • Average mass181.190 Da
  • Monoisotopic mass181.052765 Da
  • ChemSpider ID60819889

More details:

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

2-Ethinyl-3-chinolincarbaldehyd [German] [ACD/IUPAC Name]
2-Éthynyl-3-quinoléinecarbaldéhyde [French] [ACD/IUPAC Name]
2-Ethynyl-3-quinolinecarbaldehyde [ACD/IUPAC Name]
3-Quinolinecarboxaldehyde, 2-ethynyl- [ACD/Index Name]
872596-59-3 [RN]
MFCD24674706

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

Density: 1.2±0.1 g/cm3
Boiling Point: 360.1±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.6±3.0 kJ/mol
Flash Point: 179.3±31.1 °C
Index of Refraction: 1.652
Molar Refractivity: 54.1±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.11
ACD/LogD (pH 5.5): 2.19
ACD/BCF (pH 5.5): 27.26
ACD/KOC (pH 5.5): 370.80
ACD/LogD (pH 7.4): 2.19
ACD/BCF (pH 7.4): 27.26
ACD/KOC (pH 7.4): 370.80
Polar Surface Area: 30 Å2
Polarizability: 21.5±0.5 10-24cm3
Surface Tension: 59.3±5.0 dyne/cm
Molar Volume: 148.0±5.0 cm3

Click to predict properties on the Chemicalize site


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