ChemSpider 2D Image | N-[3-(4-Isopropoxyphenyl)-4-methylpentyl]-2,2-dimethyltetrahydro-2H-pyran-4-amine | C22H37NO2

N-[3-(4-Isopropoxyphenyl)-4-methylpentyl]-2,2-dimethyltetrahydro-2H-pyran-4-amine

  • Molecular FormulaC22H37NO2
  • Average mass347.535 Da
  • Monoisotopic mass347.282440 Da
  • ChemSpider ID24600991

More details:

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

2H-Pyran-4-amine, tetrahydro-2,2-dimethyl-N-[4-methyl-3-[4-(1-methylethoxy)phenyl]pentyl]- [ACD/Index Name]
N-[3-(4-Isopropoxyphenyl)-4-methylpentyl]-2,2-dimethyltetrahydro-2H-pyran-4-amin [German] [ACD/IUPAC Name]
N-[3-(4-Isopropoxyphenyl)-4-methylpentyl]-2,2-dimethyltetrahydro-2H-pyran-4-amine [ACD/IUPAC Name]
N-[3-(4-Isopropoxyphényl)-4-méthylpentyl]-2,2-diméthyltétrahydro-2H-pyran-4-amine [French] [ACD/IUPAC Name]
1144479-43-5 [RN]
2,2-dimethyl-N-[4-methyl-3-(4-propan-2-yloxyphenyl)pentyl]oxan-4-amine

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 449.2±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.8±3.0 kJ/mol
    Flash Point: 202.4±18.2 °C
    Index of Refraction: 1.508
    Molar Refractivity: 105.8±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 4.85
    ACD/LogD (pH 5.5): 1.91
    ACD/BCF (pH 5.5): 3.02
    ACD/KOC (pH 5.5): 10.27
    ACD/LogD (pH 7.4): 2.64
    ACD/BCF (pH 7.4): 16.25
    ACD/KOC (pH 7.4): 55.19
    Polar Surface Area: 30 Å2
    Polarizability: 42.0±0.5 10-24cm3
    Surface Tension: 36.1±5.0 dyne/cm
    Molar Volume: 355.2±5.0 cm3

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