ChemSpider 2D Image | 3-Hydroxy(13,14,15,16,17,18-~13~C_6_)estra-1,3,5(10)-trien-17-one | C1213C6H22O2

3-Hydroxy(13,14,15,16,17,18-13C6)estra-1,3,5(10)-trien-17-one

  • Molecular FormulaC1213C6H22O2
  • Average mass276.322 Da
  • Monoisotopic mass276.182098 Da
  • ChemSpider ID95600783

  • defined stereocentres - 4 of 4 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

3-Hydroxy(13,14,15,16,17,18-13C6)estra-1,3,5(10)-trien-17-on [German] [ACD/IUPAC Name]
3-Hydroxy(13,14,15,16,17,18-13C6)estra-1,3,5(10)-trien-17-one [ACD/IUPAC Name]
3-Hydroxy(13,14,15,16,17,18-13C6)estra-1,3,5(10)-trién-17-one [French] [ACD/IUPAC Name]
Estra-1,3,5(10)-trien-17-one-13,14,15,16,17,18-13C6, 3-hydroxy- [ACD/Index Name]
3175-95-9 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.587
Molar Refractivity: 78.0±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 30.9±0.5 10-24cm3
Surface Tension: 46.1±3.0 dyne/cm
Molar Volume: 232.1±3.0 cm3

Click to predict properties on the Chemicalize site


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