ChemSpider 2D Image | (17alpha)-17-Hydroxy(2,2,4,6,6,10-~2~H_6_)-19-norpregn-4-en-20-yn-3-one | C20H20D6O2

(17α)-17-Hydroxy(2,2,4,6,6,10-2H6)-19-norpregn-4-en-20-yn-3-one

  • Molecular FormulaC20H20D6O2
  • Average mass304.456 Da
  • Monoisotopic mass304.230927 Da
  • ChemSpider ID103835344

  • defined stereocentres - 6 of 6 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(17α)-17-Hydroxy(2,2,4,6,6,10-2H6)-19-norpregn-4-en-20-in-3-on [German] [ACD/IUPAC Name]
(17α)-17-Hydroxy(2,2,4,6,6,10-2H6)-19-norpregn-4-en-20-yn-3-one [ACD/IUPAC Name]
(17α)-17-Hydroxy(2,2,4,6,6,10-2H6)-19-norprégn-4-én-20-yn-3-one [French] [ACD/IUPAC Name]
Estr-4-en-3-one-2,2,4,6,6,10-d6, 17-ethynyl-17-hydroxy-, (17β)- [ACD/Index Name]
17α-hydroxy-19-norpregn-4-en-20-yn-3-one-2,2,4,6,6,10-d6
2376036-05-2 [RN]
NORETHINDRONE-D6

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

Density: 1.2±0.1 g/cm3
Boiling Point: 447.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 81.4±6.0 kJ/mol
Flash Point: 190.5±21.3 °C
Index of Refraction: 1.577
Molar Refractivity: 85.6±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.38
ACD/LogD (pH 5.5): 2.98
ACD/BCF (pH 5.5): 108.64
ACD/KOC (pH 5.5): 997.63
ACD/LogD (pH 7.4): 2.98
ACD/BCF (pH 7.4): 108.64
ACD/KOC (pH 7.4): 997.63
Polar Surface Area: 37 Å2
Polarizability: 33.9±0.5 10-24cm3
Surface Tension: 49.1±5.0 dyne/cm
Molar Volume: 258.1±5.0 cm3

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