Product Name

  • Name

    2-Heptyl-1,4-dihydro-4-oxo-3-quinolinecarboxaldehyde

  • EINECS
  • CAS No. 402718-53-0
  • Article Data4
  • CAS DataBase
  • Density 1.108
  • Solubility
  • Melting Point
  • Formula C17H21NO2
  • Boiling Point 407.1±45.0 °C(Predicted)
  • Molecular Weight 271.35400
  • Flash Point
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 402718-53-0 (2-Heptyl-1,4-dihydro-4-oxo-3-quinolinecarboxaldehyde)
  • Hazard Symbols
  • Synonyms 2-heptyl-1,4-dihydro-4-oxo-3-quinolinecarbaldehyde;3-formyl-2-heptylquinolone;3-formyl-2-heptyl-4-quinolone;2-Heptyl-4-oxo-1,4-dihydroquinoline-3-carbaldehyde;
  • PSA 49.93000
  • LogP 3.85350

2-Heptyl-1,4-dihydro-4-oxo-3-quinolinecarboxaldehyde Chemical Properties

Molecular Structure of 2-Heptyl-1,4-dihydro-4-oxo-3-quinolinecarboxaldehyde (CAS No.402718-53-0):

Molecular Formula: C17H21NO2
Molecular Weight: 271.3541
CAS No: 402718-53-0
H bond acceptors: 3
H bond donors: 1
Freely Rotating Bonds: 7
Polar Surface Area: 46.17 Å2
Index of Refraction: 1.573
Molar Refractivity: 80.601 cm3
Molar Volume: 244.754 cm3
Surface Tension: 45.473 dyne/cm
Density: 1.109 g/cm3
Flash Point: 140.62 °C
Enthalpy of Vaporization: 65.898 kJ/mol
Boiling Point: 407.141 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25°C
Systematic Name: 2-Heptyl-4-oxo-1,4-dihydroquinoline-3-carbaldehyde
InChI: InChI=1/C17H21NO2/c1-2-3-4-5-6-10-16-14(12-19)17(20)13-9-7-8-11-15(13)18-16/h7-9,11-12H,2-6,10H2,1H3,(H,18,20)
InChIKey: YDGMJDFKESRTIZ-UHFFFAOYAA
Std. InChI: InChI=1S/C17H21NO2/c1-2-3-4-5-6-10-16-14(12-19)17(20)13-9-7-8-11-15(13)18-16/h7-9,11-12H,2-6,10H2,1H3,(H,18,20)
Std. InChIKey: YDGMJDFKESRTIZ-UHFFFAOYSA-N

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