ChemSpider 2D Image | 2-[({2-[(4-Methylbenzyl)oxy]-1-naphthyl}methyl)amino]-1-phenylethanol | C27H27NO2

2-[({2-[(4-Methylbenzyl)oxy]-1-naphthyl}methyl)amino]-1-phenylethanol

  • Molecular FormulaC27H27NO2
  • Average mass397.509 Da
  • Monoisotopic mass397.204193 Da
  • ChemSpider ID21536472

More details:

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

2-[({2-[(4-Methylbenzyl)oxy]-1-naphthyl}methyl)amino]-1-phenylethanol [ACD/IUPAC Name]
2-[({2-[(4-Methylbenzyl)oxy]-1-naphthyl}methyl)amino]-1-phenylethanol [German] [ACD/IUPAC Name]
2-[({2-[(4-Méthylbenzyl)oxy]-1-naphtyl}méthyl)amino]-1-phényléthanol [French] [ACD/IUPAC Name]
Benzenemethanol, α-[[[[2-[(4-methylphenyl)methoxy]-1-naphthalenyl]methyl]amino]methyl]- [ACD/Index Name]
1017514-21-4 [RN]
2-[({2-[(4-methylbenzyl)oxy]naphthalen-1-yl}methyl)amino]-1-phenylethanol
2-[({2-[(4-METHYLPHENYL)METHOXY]NAPHTHALEN-1-YL}METHYL)AMINO]-1-PHENYLETHAN-1-OL
2-[({2-[(4-METHYLPHENYL)METHOXY]NAPHTHALEN-1-YL}METHYL)AMINO]-1-PHENYLETHANOL
2-[[2-[(4-methylphenyl)methoxy]naphthalen-1-yl]methylamino]-1-phenylethanol
2-{[2-(4-Methyl-benzyloxy)-naphthalen-1-ylmethyl]-amino}-1-phenyl-ethanol

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 586.5±29.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 92.1±3.0 kJ/mol
    Flash Point: 308.5±24.3 °C
    Index of Refraction: 1.645
    Molar Refractivity: 123.9±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 1
    ACD/LogP: 6.09
    ACD/LogD (pH 5.5): 3.81
    ACD/BCF (pH 5.5): 151.95
    ACD/KOC (pH 5.5): 340.73
    ACD/LogD (pH 7.4): 5.44
    ACD/BCF (pH 7.4): 6509.02
    ACD/KOC (pH 7.4): 14596.03
    Polar Surface Area: 41 Å2
    Polarizability: 49.1±0.5 10-24cm3
    Surface Tension: 50.2±3.0 dyne/cm
    Molar Volume: 341.6±3.0 cm3

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