ChemSpider 2D Image | (17beta)-3-Methoxy-17-(tetrahydro-2H-pyran-2-yloxy)estra-1,3,5(10)-triene | C24H34O3

(17β)-3-Methoxy-17-(tetrahydro-2H-pyran-2-yloxy)estra-1,3,5(10)-triene

  • Molecular FormulaC24H34O3
  • Average mass370.525 Da
  • Monoisotopic mass370.250793 Da
  • ChemSpider ID31046844

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

(17β)-3-Methoxy-17-(tetrahydro-2H-pyran-2-yloxy)estra-1,3,5(10)-trien [German] [ACD/IUPAC Name]
(17β)-3-Methoxy-17-(tetrahydro-2H-pyran-2-yloxy)estra-1,3,5(10)-triene [ACD/IUPAC Name]
(17β)-3-Méthoxy-17-(tétrahydro-2H-pyran-2-yloxy)estra-1,3,5(10)-triène [French] [ACD/IUPAC Name]
Estra-1,3,5(10)-triene, 3-methoxy-17-[(tetrahydro-2H-pyran-2-yl)oxy]-, (17β)- [ACD/Index Name]
(17β)-3-Methoxy-17-[(oxan-2-yl)oxy]estra-1,3,5(10)-triene
2-[[(8R,9S,13S,14S,17S)-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]oxy]oxane
3-O-Methyl 17b-Estradiol
3-O-Methyl 17β-Estradiol 17-O-Tetrahydropyran (Mixture of Diastereomers)
4811-74-9 [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: 495.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.5±3.0 kJ/mol
Flash Point: 170.3±26.0 °C
Index of Refraction: 1.562
Molar Refractivity: 107.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.66
ACD/LogD (pH 5.5): 5.16
ACD/BCF (pH 5.5): 4922.26
ACD/KOC (pH 5.5): 15291.30
ACD/LogD (pH 7.4): 5.16
ACD/BCF (pH 7.4): 4922.26
ACD/KOC (pH 7.4): 15291.30
Polar Surface Area: 28 Å2
Polarizability: 42.4±0.5 10-24cm3
Surface Tension: 44.2±5.0 dyne/cm
Molar Volume: 329.8±5.0 cm3

Click to predict properties on the Chemicalize site


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