ChemSpider 2D Image | 3-(10H-Phenothiazin-10-ylmethyl)-1-azoniabicyclo[2.2.2]octane | C20H23N2S

3-(10H-Phenothiazin-10-ylmethyl)-1-azoniabicyclo[2.2.2]octane

  • Molecular FormulaC20H23N2S
  • Average mass323.474 Da
  • Monoisotopic mass323.157654 Da
  • ChemSpider ID23097923

  • Charge - Charge

More details:

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

10H-Phenothiazine, 10-(1-azabicyclo[2.2.2]oct-3-ylmethyl)-, conjugate monoacid [ACD/Index Name]
3-(10H-Phenothiazin-10-ylmethyl)-1-azoniabicyclo[2.2.2]octan [German] [ACD/IUPAC Name]
3-(10H-Phenothiazin-10-ylmethyl)-1-azoniabicyclo[2.2.2]octane [ACD/IUPAC Name]
3-(10H-Phénothiazin-10-ylméthyl)-1-azoniabicyclo[2.2.2]octane [French] [ACD/IUPAC Name]
3-Phenothiazin-10-ylmethyl-1-azonia-bicyclo[2.2.2]octane
ZINC01567421, 6

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

Density:
Boiling Point: 469.4±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.2±3.0 kJ/mol
Flash Point: 237.7±22.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.38
ACD/LogD (pH 5.5): 1.72
ACD/BCF (pH 5.5): 2.15
ACD/KOC (pH 5.5): 7.96
ACD/LogD (pH 7.4): 2.11
ACD/BCF (pH 7.4): 5.32
ACD/KOC (pH 7.4): 19.70
Polar Surface Area: 33 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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