ChemSpider 2D Image | Nandrolone cyclotate | C28H38O3

Nandrolone cyclotate

  • Molecular FormulaC28H38O3
  • Average mass422.599 Da
  • Monoisotopic mass422.282104 Da
  • ChemSpider ID32700233
  • defined stereocentres - 8 of 8 defined stereocentres


More details:






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

(17β)-3-Oxoestr-4-en-17-yl (1r,4S)-4-methylbicyclo[2.2.2]oct-2-ene-1-carboxylate [ACD/IUPAC Name]
(17β)-3-Oxoestr-4-en-17-yl-(1r,4S)-4-methylbicyclo[2.2.2]oct-2-en-1-carboxylat [German] [ACD/IUPAC Name]
(1r,4S)-4-Méthylbicyclo[2.2.2]oct-2-ène-1-carboxylate de (17β)-3-oxoestr-4-én-17-yle [French] [ACD/IUPAC Name]
Bicyclo[2.2.2]oct-2-ene-1-carboxylic acid, 4-methyl-, (17β)-3-oxoestr-4-en-17-yl ester [ACD/Index Name]
nandrolone ciclotate
Nandrolone cyclotate [USAN] [Wiki]
UNII:1MG9GW4ZH8
(17β)-3-Oxoestr-4-en-17-yl 4-methylbicyclo[2.2.2]oct-2-ene-1-carboxylate [ACD/IUPAC Name]
[(8R,9S,10R,13S,14S,17S)-13-methyl-3-oxo-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] 4-methylbicyclo[2.2.2]oct-2-ene-1-carboxylate
22263-51-0 [RN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 534.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.1±3.0 kJ/mol
Flash Point: 228.1±30.2 °C
Index of Refraction: 1.577
Molar Refractivity: 120.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.50
ACD/LogD (pH 5.5): 5.83
ACD/BCF (pH 5.5): 15782.57
ACD/KOC (pH 5.5): 35208.12
ACD/LogD (pH 7.4): 5.83
ACD/BCF (pH 7.4): 15782.57
ACD/KOC (pH 7.4): 35208.12
Polar Surface Area: 43 Å2
Polarizability: 47.9±0.5 10-24cm3
Surface Tension: 47.1±5.0 dyne/cm
Molar Volume: 364.9±5.0 cm3

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