ChemSpider 2D Image | 3-Methyl-5-(4-propoxyphenyl)-1,2,3,4-tetrahydrobenzo[a]phenanthridine | C27H27NO

3-Methyl-5-(4-propoxyphenyl)-1,2,3,4-tetrahydrobenzo[a]phenanthridine

  • Molecular FormulaC27H27NO
  • Average mass381.509 Da
  • Monoisotopic mass381.209259 Da
  • ChemSpider ID21686542

More details:






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

3-Methyl-5-(4-propoxyphenyl)-1,2,3,4-tetrahydrobenzo[a]phenanthridin [German] [ACD/IUPAC Name]
3-Methyl-5-(4-propoxyphenyl)-1,2,3,4-tetrahydrobenzo[a]phenanthridine [ACD/IUPAC Name]
3-Méthyl-5-(4-propoxyphényl)-1,2,3,4-tétrahydrobenzo[a]phénanthridine [French] [ACD/IUPAC Name]
Benzo[a]phenanthridine, 1,2,3,4-tetrahydro-3-methyl-5-(4-propoxyphenyl)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 581.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 83.7±3.0 kJ/mol
Flash Point: 202.4±20.4 °C
Index of Refraction: 1.637
Molar Refractivity: 122.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 8.19
ACD/LogD (pH 5.5): 6.71
ACD/BCF (pH 5.5): 49749.45
ACD/KOC (pH 5.5): 50100.16
ACD/LogD (pH 7.4): 7.40
ACD/BCF (pH 7.4): 245929.69
ACD/KOC (pH 7.4): 247663.36
Polar Surface Area: 22 Å2
Polarizability: 48.4±0.5 10-24cm3
Surface Tension: 45.7±3.0 dyne/cm
Molar Volume: 340.0±3.0 cm3

Click to predict properties on the Chemicalize site






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