Found 54 results

Search term: MF = 'C_{33}H_{56}O_{3}'
ChemSpider 2D Image | 9,19-Cyclolanostane-3,24,25-triol, cyclic 24,25-(1-methylethylidene acetal), (3β,24S)- | C33H56O3

9,19-Cyclolanostane-3,24,25-triol, cyclic 24,25-(1-methylethylidene acetal), (3β,24S)-

  • Molecular FormulaC33H56O3
  • Average mass500.796 Da
  • Monoisotopic mass500.422943 Da
  • ChemSpider ID28424346

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(1R,3aS,3bS,5aR,7S,9aR,10aS,12aR)-3a,6,6,12a-Tetramethyl-1-{(2R)-4-[(4S)-2,2,5,5-tetramethyl-1,3-dioxolan-4-yl]-2-butanyl}tetradecahydro-1H-cyclopenta[a]cyclopropa[e]phenanthren-7-ol (non-preferred na me) [ACD/IUPAC Name]
(1R,3aS,3bS,5aR,7S,9aR,10aS,12aR)-3a,6,6,12a-Tetramethyl-1-{(2R)-4-[(4S)-2,2,5,5-tetramethyl-1,3-dioxolan-4-yl]-2-butanyl}tetradecahydro-1H-cyclopenta[a]cyclopropa[e]phenanthren-7-ol (non-preferred na me) [German] [ACD/IUPAC Name]
(1R,3aS,3bS,5aR,7S,9aR,10aS,12aR)-3a,6,6,12a-Tétraméthyl-1-{(2R)-4-[(4S)-2,2,5,5-tétraméthyl-1,3-dioxolan-4-yl]-2-butanyl}tétradécahydro-1H-cyclopenta[a]cyclopropa[e]phénanthrén-7-ol (non-preferred na me) [French] [ACD/IUPAC Name]
57576-31-5 [RN]
9,19-Cyclolanostane-3,24,25-triol, cyclic 24,25-(1-methylethylidene acetal), (3β,24S)-
(24S)cycloartane-3,24,25-triol 24,25-acetonide
(24S)-Cycloartane-3,24,25-triol 24,25-acetonide
[57576-31-5] [RN]
MFCD20260512

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 552.5±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.4 mmHg at 25°C
    Enthalpy of Vaporization: 95.8±6.0 kJ/mol
    Flash Point: 287.9±23.2 °C
    Index of Refraction: 1.539
    Molar Refractivity: 147.5±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 2
    ACD/LogP: 9.64
    ACD/LogD (pH 5.5): 8.74
    ACD/BCF (pH 5.5): 1000000.00
    ACD/KOC (pH 5.5): 1355970.75
    ACD/LogD (pH 7.4): 8.74
    ACD/BCF (pH 7.4): 1000000.00
    ACD/KOC (pH 7.4): 1355970.75
    Polar Surface Area: 39 Å2
    Polarizability: 58.5±0.5 10-24cm3
    Surface Tension: 41.5±5.0 dyne/cm
    Molar Volume: 470.7±5.0 cm3

    Click to predict properties on the Chemicalize site


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