ChemSpider 2D Image | 1,4-Androstadienedione | C19H32O2

1,4-Androstadienedione

  • Molecular FormulaC19H32O2
  • Average mass292.456 Da
  • Monoisotopic mass292.240234 Da
  • ChemSpider ID21112164
  • defined stereocentres - 6 of 8 defined stereocentres


More details:






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

(5α)-Androstane-3,17-diol
(5α)-Androstan-3,17-diol [German] [ACD/IUPAC Name]
(5α)-Androstane-3,17-diol [ACD/IUPAC Name]
(5α)-Androstane-3,17-diol [French] [ACD/IUPAC Name]
1,4-Androstadienedione
21862-74-8 [RN]
Androstane-3,17-diol, (5α)- [ACD/Index Name]
MFCD00003614 [MDL number]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 415.0±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 77.2±6.0 kJ/mol
Flash Point: 186.0±15.8 °C
Index of Refraction: 1.546
Molar Refractivity: 85.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.33
ACD/LogD (pH 5.5): 3.53
ACD/BCF (pH 5.5): 285.89
ACD/KOC (pH 5.5): 1994.15
ACD/LogD (pH 7.4): 3.53
ACD/BCF (pH 7.4): 285.89
ACD/KOC (pH 7.4): 1994.15
Polar Surface Area: 40 Å2
Polarizability: 33.7±0.5 10-24cm3
Surface Tension: 42.6±3.0 dyne/cm
Molar Volume: 268.1±3.0 cm3

Click to predict properties on the Chemicalize site






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