Found 31 results

Search term: MF = 'C_{33}H_{47}NO_{3}'
ChemSpider 2D Image | 4a-Benzyl-7-{[5-(4-morpholinyl)pentyl]oxy}-2-propyl-1,2,3,4,4a,9,10,10a-octahydro-2-phenanthrenol | C33H47NO3

4a-Benzyl-7-{[5-(4-morpholinyl)pentyl]oxy}-2-propyl-1,2,3,4,4a,9,10,10a-octahydro-2-phenanthrenol

  • Molecular FormulaC33H47NO3
  • Average mass505.731 Da
  • Monoisotopic mass505.355591 Da
  • ChemSpider ID8003264

More details:

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

2-Phenanthrenol, 1,2,3,4,4a,9,10,10a-octahydro-7-[[5-(4-morpholinyl)pentyl]oxy]-4a-(phenylmethyl)-2-propyl- [ACD/Index Name]
4a-Benzyl-7-{[5-(4-morpholinyl)pentyl]oxy}-2-propyl-1,2,3,4,4a,9,10,10a-octahydro-2-phenanthrenol [ACD/IUPAC Name]
4a-Benzyl-7-{[5-(4-morpholinyl)pentyl]oxy}-2-propyl-1,2,3,4,4a,9,10,10a-octahydro-2-phenanthrenol [German] [ACD/IUPAC Name]
4a-Benzyl-7-{[5-(4-morpholinyl)pentyl]oxy}-2-propyl-1,2,3,4,4a,9,10,10a-octahydro-2-phénanthrénol [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 639.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.2±3.0 kJ/mol
Flash Point: 340.5±31.5 °C
Index of Refraction: 1.562
Molar Refractivity: 150.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 7.76
ACD/LogD (pH 5.5): 5.14
ACD/BCF (pH 5.5): 1562.90
ACD/KOC (pH 5.5): 1805.33
ACD/LogD (pH 7.4): 6.77
ACD/BCF (pH 7.4): 67030.80
ACD/KOC (pH 7.4): 77428.14
Polar Surface Area: 42 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 44.4±3.0 dyne/cm
Molar Volume: 465.4±3.0 cm3

Click to predict properties on the Chemicalize site


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