ChemSpider 2D Image | CHEMBRDG-BB 9071637 | C16H23NO

CHEMBRDG-BB 9071637

  • Molecular FormulaC16H23NO
  • Average mass245.360 Da
  • Monoisotopic mass245.177963 Da
  • ChemSpider ID21612922

More details:

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

2,5-Dimethyl-3-[(2-methyl-1-piperidinyl)methyl]benzaldehyd [German] [ACD/IUPAC Name]
2,5-Dimethyl-3-[(2-methyl-1-piperidinyl)methyl]benzaldehyde [ACD/IUPAC Name]
2,5-Diméthyl-3-[(2-méthyl-1-pipéridinyl)méthyl]benzaldéhyde [French] [ACD/IUPAC Name]
2,5-dimethyl-3-[(2-methylpiperidin-1-yl)methyl]benzaldehyde
894213-68-4 [RN]
Benzaldehyde, 2,5-dimethyl-3-[(2-methyl-1-piperidinyl)methyl]- [ACD/Index Name]
CHEMBRDG-BB 9071637
MFCD07156457 [MDL number]
2,5-Dimethyl-3-((2-methylpiperidin-1-yl)methyl)benzaldehyde
2,5-Dimethyl-3-(2-methyl-piperidin-1-ylmethyl)-benzaldehyde

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 353.2±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 59.8±3.0 kJ/mol
    Flash Point: 121.6±13.9 °C
    Index of Refraction: 1.554
    Molar Refractivity: 76.9±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.59
    ACD/LogD (pH 5.5): 0.94
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 3.27
    ACD/LogD (pH 7.4): 2.10
    ACD/BCF (pH 7.4): 8.39
    ACD/KOC (pH 7.4): 47.34
    Polar Surface Area: 20 Å2
    Polarizability: 30.5±0.5 10-24cm3
    Surface Tension: 39.7±3.0 dyne/cm
    Molar Volume: 240.0±3.0 cm3

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