ChemSpider 2D Image | (17beta)-3-Oxoandrost-4-en-17-yl 2-undecenoate | C30H46O3

(17β)-3-Oxoandrost-4-en-17-yl 2-undecenoate

  • Molecular FormulaC30H46O3
  • Average mass454.684 Da
  • Monoisotopic mass454.344696 Da
  • ChemSpider ID21229627

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(17β)-3-Oxoandrost-4-en-17-yl 2-undecenoate [ACD/IUPAC Name]
(17β)-3-Oxoandrost-4-en-17-yl-2-undecenoat [German] [ACD/IUPAC Name]
249-624-7 [EINECS]
29430-26-0 [RN]
2-Undécénoate de (17β)-3-oxoandrost-4-én-17-yle [French] [ACD/IUPAC Name]
2-Undecenoic acid, (17β)-3-oxoandrost-4-en-17-yl ester [ACD/Index Name]
17β-hydroxyandrost-4-en-3-one undecenoate

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

Density: 1.0±0.1 g/cm3
Boiling Point: 553.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.5±3.0 kJ/mol
Flash Point: 232.1±30.2 °C
Index of Refraction: 1.532
Molar Refractivity: 134.3±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 9.23
ACD/LogD (pH 5.5): 8.69
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1270273.13
ACD/LogD (pH 7.4): 8.69
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1270273.13
Polar Surface Area: 43 Å2
Polarizability: 53.2±0.5 10-24cm3
Surface Tension: 41.5±5.0 dyne/cm
Molar Volume: 433.7±5.0 cm3

Click to predict properties on the Chemicalize site


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