ChemSpider 2D Image | 5-Amino-9,10-dihydro-8H-cyclopenta[5',6']pyrido[3',2':4,5]thieno[3,2-c]isoquinolin-6-ium | C17H14N3S

5-Amino-9,10-dihydro-8H-cyclopenta[5',6']pyrido[3',2':4,5]thieno[3,2-c]isoquinolin-6-ium

  • Molecular FormulaC17H14N3S
  • Average mass292.378 Da
  • Monoisotopic mass292.090302 Da
  • ChemSpider ID21209159

  • Charge - Charge

More details:

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

5-Amino-9,10-dihydro-8H-cyclopenta[5',6']pyrido[3',2':4,5]thieno[3,2-c]isochinolin-6-ium [German] [ACD/IUPAC Name]
5-Amino-9,10-dihydro-8H-cyclopenta[5',6']pyrido[3',2':4,5]thiéno[3,2-c]isoquinoléin-6-ium [French] [ACD/IUPAC Name]
5-Amino-9,10-dihydro-8H-cyclopenta[5',6']pyrido[3',2':4,5]thieno[3,2-c]isoquinolin-6-ium [ACD/IUPAC Name]
8H-Cyclopenta[5',6']pyrido[3',2':4,5]thieno[3,2-c]isoquinolinium, 5-amino-9,10-dihydro- [ACD/Index Name]
ZINC03862842

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

Density:
Boiling Point: 564.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.8±3.0 kJ/mol
Flash Point: 295.0±28.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.21
ACD/LogD (pH 5.5): 3.44
ACD/BCF (pH 5.5): 177.86
ACD/KOC (pH 5.5): 986.15
ACD/LogD (pH 7.4): 3.98
ACD/BCF (pH 7.4): 620.64
ACD/KOC (pH 7.4): 3441.14
Polar Surface Area: 81 Å2
Polarizability:
Surface Tension:
Molar Volume:

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