ChemSpider 2D Image | (3R,4R)-1-(4-Fluorophenyl)-3-[(3R)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)-2-azetidinone | C24H21F2NO3

(3R,4R)-1-(4-Fluorophenyl)-3-[(3R)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)-2-azetidinone

  • Molecular FormulaC24H21F2NO3
  • Average mass409.425 Da
  • Monoisotopic mass409.148956 Da
  • ChemSpider ID48061720

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(3R,4R)-1-(4-Fluorophenyl)-3-[(3R)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)-2-azetidinone [ACD/IUPAC Name]
(3R,4R)-1-(4-Fluorophényl)-3-[(3R)-3-(4-fluorophényl)-3-hydroxypropyl]-4-(4-hydroxyphényl)-2-azétidinone [French] [ACD/IUPAC Name]
(3R,4R)-1-(4-Fluorphenyl)-3-[(3R)-3-(4-fluorphenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)-2-azetidinon [German] [ACD/IUPAC Name]
2-Azetidinone, 1-(4-fluorophenyl)-3-[(3R)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)-, (3R,4R)- [ACD/Index Name]
(3’r,3r,4r)-ezetimibe
(3R,4R)-1-(4-Fluorophenyl)-3-((R)-3-(4-fluorophenyl)-3-hydroxypropyl)-4-(4-hydroxyphenyl)azetidin-2-one
(3R,4R)-1-(4-fluorophenyl)-3-[(3R)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)azetidin-2-one
1593542-96-1 [RN]
MFCD24386669

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 654.9±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 101.3±3.0 kJ/mol
    Flash Point: 349.9±31.5 °C
    Index of Refraction: 1.624
    Molar Refractivity: 108.3±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 3.26
    ACD/LogD (pH 5.5): 3.68
    ACD/BCF (pH 5.5): 366.41
    ACD/KOC (pH 5.5): 2381.67
    ACD/LogD (pH 7.4): 3.67
    ACD/BCF (pH 7.4): 364.57
    ACD/KOC (pH 7.4): 2369.71
    Polar Surface Area: 61 Å2
    Polarizability: 42.9±0.5 10-24cm3
    Surface Tension: 54.8±3.0 dyne/cm
    Molar Volume: 306.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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