ChemSpider 2D Image | (5beta,9beta,14beta)-Androst-2-en-17-one | C19H28O

(5β,9β,14β)-Androst-2-en-17-one

  • Molecular FormulaC19H28O
  • Average mass272.425 Da
  • Monoisotopic mass272.214020 Da
  • ChemSpider ID67865420

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(5β,9β,14β)-Androst-2-en-17-on [German] [ACD/IUPAC Name]
(5β,9β,14β)-Androst-2-en-17-one [ACD/IUPAC Name]
(5β,9β,14β)-Androst-2-én-17-one [French] [ACD/IUPAC Name]
Androst-2-en-17-one, (5β,9β,14β)- [ACD/Index Name]
(5R,8R,9R,10S,13S,14R)-10,13-dimethyl-5,6,7,8,9,10,11,12,13,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17(4H)-one
5α-androst-2-en-17-one
65473-13-4 [RN]
963-75-7 [RN]
MFCD00199476 [MDL number]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 371.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.9±3.0 kJ/mol
Flash Point: 157.7±22.8 °C
Index of Refraction: 1.530
Molar Refractivity: 81.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 5.30
ACD/LogD (pH 5.5): 4.43
ACD/BCF (pH 5.5): 1360.59
ACD/KOC (pH 5.5): 6091.45
ACD/LogD (pH 7.4): 4.43
ACD/BCF (pH 7.4): 1360.59
ACD/KOC (pH 7.4): 6091.45
Polar Surface Area: 17 Å2
Polarizability: 32.3±0.5 10-24cm3
Surface Tension: 36.9±3.0 dyne/cm
Molar Volume: 263.9±3.0 cm3

Click to predict properties on the Chemicalize site


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