ChemSpider 2D Image | 3-[(~13~C,~2~H_3_)Methyloxy]estra-1,3,5(10)-trien-17-one | C1813CH21D3O2

3-[(13C,2H3)Methyloxy]estra-1,3,5(10)-trien-17-one

  • Molecular FormulaC1813CH21D3O2
  • Average mass288.404 Da
  • Monoisotopic mass288.199829 Da
  • ChemSpider ID62877004

  • 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-[(13C,2H3)Methyloxy]estra-1,3,5(10)-trien-17-on [German] [ACD/IUPAC Name]
3-[(13C,2H3)Methyloxy]estra-1,3,5(10)-trien-17-one [ACD/IUPAC Name]
3-[(13C,2H3)Méthyloxy]estra-1,3,5(10)-trién-17-one [French] [ACD/IUPAC Name]
Estra-1,3,5(10)-trien-17-one, 3-(methyl-13C-d3-oxy)- [ACD/Index Name]
1261254-60-7 [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.556
Molar Refractivity: 82.8±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: 32.8±0.5 10-24cm3
Surface Tension: 40.0±3.0 dyne/cm
Molar Volume: 257.7±3.0 cm3

Click to predict properties on the Chemicalize site


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