ChemSpider 2D Image | Dihydropleuromutilin | C22H36O5

Dihydropleuromutilin

  • Molecular FormulaC22H36O5
  • Average mass380.518 Da
  • Monoisotopic mass380.256287 Da
  • ChemSpider ID23976739

  • defined stereocentres - 6 of 8 defined stereocentres

More details:

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

(2R,3S,4R,6R,8R,14R)-4-Ethyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxotricyclo[5.4.3.01,8]tetradec-6-yl glycolate [ACD/IUPAC Name]
(2R,3S,4R,6R,8R,14R)-4-Ethyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxotricyclo[5.4.3.01,8]tetradec-6-ylglycolat [German] [ACD/IUPAC Name]
42302-24-9 [RN]
Acetic acid, 2-hydroxy-, (4R,5S,6R,8R,9aR,10R)-6-ethyldecahydro-5-hydroxy-4,6,9,10-tetramethyl-1-oxo-3a,9-propano-3aH-cyclopentacycloocten-8-yl ester [ACD/Index Name]
Dihydropleuromutilin
Glycolate de (2R,3S,4R,6R,8R,14R)-4-éthyl-3-hydroxy-2,4,7,14-tétraméthyl-9-oxotricyclo[5.4.3.01,8]tétradéc-6-yle [French] [ACD/IUPAC Name]
(4R,5S,6R,8R,9aR,10R)-6-Ethyl-5-hydroxy-4,6,9,10-tetramethyl-1-oxodecahydro-3a,9-propanocyclopenta[8]annulen-8-yl hydroxyacetate
1217512-98-5 [RN]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 503.3±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.9 mmHg at 25°C
    Enthalpy of Vaporization: 89.0±6.0 kJ/mol
    Flash Point: 166.4±23.6 °C
    Index of Refraction: 1.530
    Molar Refractivity: 102.7±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.05
    ACD/LogD (pH 5.5): 3.43
    ACD/BCF (pH 5.5): 238.96
    ACD/KOC (pH 5.5): 1753.94
    ACD/LogD (pH 7.4): 3.43
    ACD/BCF (pH 7.4): 238.96
    ACD/KOC (pH 7.4): 1753.94
    Polar Surface Area: 84 Å2
    Polarizability: 40.7±0.5 10-24cm3
    Surface Tension: 46.1±5.0 dyne/cm
    Molar Volume: 332.5±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement