ChemSpider 2D Image | (R)-Fexofenadine | C32H39NO4

(R)-Fexofenadine

  • Molecular FormulaC32H39NO4
  • Average mass501.656 Da
  • Monoisotopic mass501.287903 Da
  • ChemSpider ID8046346

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(R)-Fexofenadine
139965-10-9 [RN]
2-{4-[(1R)-1-Hydroxy-4-{4-[hydroxy(diphenyl)methyl]-1-piperidinyl}butyl]phenyl}-2-methylpropanoic acid [ACD/IUPAC Name]
2-{4-[(1R)-1-Hydroxy-4-{4-[hydroxy(diphenyl)methyl]-1-piperidinyl}butyl]phenyl}-2-methylpropansäure [German] [ACD/IUPAC Name]
2-{4-[(1R)-1-hydroxy-4-{4-[hydroxy(diphenyl)methyl]piperidin-1-yl}butyl]phenyl}-2-methylpropanoic acid
Acide 2-{4-[(1R)-1-hydroxy-4-{4-[hydroxy(diphényl)méthyl]-1-pipéridinyl}butyl]phényl}-2-méthylpropanoïque [French] [ACD/IUPAC Name]
Benzeneacetic acid, 4-[(1R)-1-hydroxy-4-[4-(hydroxydiphenylmethyl)-1-piperidinyl]butyl]-α,α-dimethyl- [ACD/Index Name]
(R)-2-(4-(1-Hydroxy-4-(4-(hydroxydiphenylmethyl)piperidin-1-yl)butyl)phenyl)-2-methylpropanoic acid
?R?-Fexofenadine
153439-40-8 [RN]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 697.3±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.3 mmHg at 25°C
    Enthalpy of Vaporization: 107.2±3.0 kJ/mol
    Flash Point: 375.5±31.5 °C
    Index of Refraction: 1.597
    Molar Refractivity: 145.9±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 3
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 1
    ACD/LogP: 4.80
    ACD/LogD (pH 5.5): 2.41
    ACD/BCF (pH 5.5): 9.83
    ACD/KOC (pH 5.5): 34.25
    ACD/LogD (pH 7.4): 2.43
    ACD/BCF (pH 7.4): 10.33
    ACD/KOC (pH 7.4): 35.99
    Polar Surface Area: 81 Å2
    Polarizability: 57.8±0.5 10-24cm3
    Surface Tension: 52.4±3.0 dyne/cm
    Molar Volume: 428.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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