ChemSpider 2D Image | 7?,17?-dimethyl-5?-androstane-3?,17?-diol | C21H36O2

7?,17?-dimethyl-5?-androstane-3?,17?-diol

  • Molecular FormulaC21H36O2
  • Average mass320.509 Da
  • Monoisotopic mass320.271515 Da
  • ChemSpider ID23254171

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(3α,5β,7α,17β)-7,17-Dimethylandrostan-3,17-diol [German] [ACD/IUPAC Name]
(3α,5β,7α,17β)-7,17-Dimethylandrostane-3,17-diol [ACD/IUPAC Name]
(3α,5β,7α,17β)-7,17-Diméthylandrostane-3,17-diol [French] [ACD/IUPAC Name]
13611-10-4 [RN]
7?,17?-dimethyl-5?-androstane-3?,17?-diol
Androstane-3,17-diol, 7,17-dimethyl-, (3α,5β,7α,17β)- [ACD/Index Name]
(1S,2S,5R,7R,9R,10R,11S,14S,15S)-2,9,14,15-tetramethyltetracyclo[8.7.0.02,7.011,15]heptadecane-5,14-diol
(1S,2S,5R,7R,9R,10R,11S,14S,15S)-2,9,14,15-tetramethyltetracyclo[8.7.0.02,7.011,15]heptadecane-5,14-diol
(3a,5b,7a,17b)-7,17-dimethyl-Androstane-3,17-diol
(3R,5R,7R,8R,9S,10S,13S,14S,17S)-7,10,13,17-Tetramethylhexadecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

Y20AM65I7W [DBID]
UNII:Y20AM65I7W [DBID]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 425.9±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.6±6.0 kJ/mol
Flash Point: 185.4±15.8 °C
Index of Refraction: 1.527
Molar Refractivity: 94.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 5.36
ACD/LogD (pH 5.5): 4.37
ACD/BCF (pH 5.5): 1236.77
ACD/KOC (pH 5.5): 5689.30
ACD/LogD (pH 7.4): 4.37
ACD/BCF (pH 7.4): 1236.77
ACD/KOC (pH 7.4): 5689.30
Polar Surface Area: 40 Å2
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 39.4±3.0 dyne/cm
Molar Volume: 306.5±3.0 cm3

Click to predict properties on the Chemicalize site


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