Found 45 results

Search term: MF = 'C_{30}H_{31}NO'
ChemSpider 2D Image | 6-Phenyl-17-(3-pyridinyl)androsta-4,14,16-trien-3-one | C30H31NO

6-Phenyl-17-(3-pyridinyl)androsta-4,14,16-trien-3-one

  • Molecular FormulaC30H31NO
  • Average mass421.573 Da
  • Monoisotopic mass421.240570 Da
  • ChemSpider ID76786162

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

6-Phenyl-17-(3-pyridinyl)androsta-4,14,16-trien-3-on [German] [ACD/IUPAC Name]
6-Phenyl-17-(3-pyridinyl)androsta-4,14,16-trien-3-one [ACD/IUPAC Name]
6-Phényl-17-(3-pyridinyl)androsta-4,14,16-trién-3-one [French] [ACD/IUPAC Name]
Androsta-4,14,16-trien-3-one, 6-phenyl-17-(3-pyridinyl)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 576.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.3±3.0 kJ/mol
Flash Point: 297.2±37.5 °C
Index of Refraction: 1.640
Molar Refractivity: 128.2±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 6.16
ACD/LogD (pH 5.5): 5.83
ACD/BCF (pH 5.5): 14240.04
ACD/KOC (pH 5.5): 28668.41
ACD/LogD (pH 7.4): 6.03
ACD/BCF (pH 7.4): 22479.45
ACD/KOC (pH 7.4): 45256.22
Polar Surface Area: 30 Å2
Polarizability: 50.8±0.5 10-24cm3
Surface Tension: 52.8±5.0 dyne/cm
Molar Volume: 355.9±5.0 cm3

Click to predict properties on the Chemicalize site


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