ChemSpider 2D Image | DROSPIRENONE 6-ENE | C23H28O3

DROSPIRENONE 6-ENE

  • Molecular FormulaC23H28O3
  • Average mass352.467 Da
  • Monoisotopic mass352.203857 Da
  • ChemSpider ID31045891

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(4aR,4bS,6aS,7S,7aS,8aS,8bS,8cR)-4a,6a-Dimethyl-4,4a,4b,6,6a,7a,8,8a,8b,8c-decahydro-3H,3'H-spiro[cyclopropa[4,5]cyclopenta[1,2-a]phenanthrene-7,2'-furan]-2,5'(4'H,5H)-dione [ACD/IUPAC Name]
67372-69-4 [RN]
DROSPIRENONE 6-ENE
Spiro[cyclopropa[4,5]cyclopenta[1,2-a]phenanthrene-7(3H),2'(5'H)-furan]-2,5'(5H)-dione, 3',4,4',4a,4b,6,6a,7a,8,8a,8b,8c-dodecahydro-4a,6a-dimethyl-, (4aR,4bS,6aS,7S,7aS,8aS,8bS,8cR)- [ACD/Index Name]
(2'S,4aR,4bS,6aS,7aS,8aS,8bS,8cR)-4a,6a-dimethyl-4,4a,4b,5,6,6a,8,8a,8b,8c-decahydro-2H,3'H-spiro[cyclopropa[4,5]cyclopenta[1,2-a]phenanthrene-7,2'-furan]-2,5'(3H,4'H,7aH)-dione
6,7-Demethylene-6,7-dehydro Drospirenone
missing

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

LF6CD1LUZA [DBID]
UNII:LF6CD1LUZA [DBID]
UNII-LF6CD1LUZA [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 556.2±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 83.8±3.0 kJ/mol
    Flash Point: 244.0±30.2 °C
    Index of Refraction: 1.604
    Molar Refractivity: 97.8±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 2.84
    ACD/LogD (pH 5.5): 2.99
    ACD/BCF (pH 5.5): 110.21
    ACD/KOC (pH 5.5): 1007.94
    ACD/LogD (pH 7.4): 2.99
    ACD/BCF (pH 7.4): 110.21
    ACD/KOC (pH 7.4): 1007.94
    Polar Surface Area: 43 Å2
    Polarizability: 38.8±0.5 10-24cm3
    Surface Tension: 49.9±5.0 dyne/cm
    Molar Volume: 284.1±5.0 cm3

    Click to predict properties on the Chemicalize site


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