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2-Cyanovaleraldehyde

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  • Name 2-Cyanovaleraldehyde
  • EINECSN/A
  • CAS No. 63744-92-3
  • Density0.937 g/cm3
  • PSA40.86000
  • LogP1.12518
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC6H9NO
  • Boiling Point182.525 °C at 760 mmHg
  • Molecular Weight111.1418
  • Flash Point64.189 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 63744-92-3 (2-formylpentanenitrile)
  • Hazard SymbolsN/A
  • SynonymsN/A

2-Cyanovaleraldehyde Specification

The Pentanenitrile, 2-formyl- is an organic compound with the formula C6H9NO. With the CAS registry number 63744-92-3, its systematic name is 2-formylpentanenitrile.

Physical properties of 2-formylpentanenitrile: (1)ACD/LogP: 0.59; (2)#H bond acceptors: 2; (3)#Freely Rotating Bonds: 3; (4)Index of Refraction: 1.418; (5)Molar Refractivity: 29.905 cm3; (6)Molar Volume: 118.654 cm3; (7)Surface Tension: 33.482 dyne/cm; (8)Density: 0.937 g/cm3; (9)Flash Point: 64.189 °C; (10)Enthalpy of Vaporization: 41.877 kJ/mol; (11)Boiling Point: 182.525 °C at 760 mmHg; (12)Vapour Pressure: 0.807 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: N#CC(CCC)C=O
(2)InChI: InChI=1/C6H9NO/c1-2-3-6(4-7)5-8/h5-6H,2-3H2,1H3
(3)InChIKey: VUXYPZAXIFRMQU-UHFFFAOYAU

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