ChemSpider 2D Image | 10-(2-Propyn-1-yl)-10H-dipyrido[3,4-b:3',4'-e][1,4]thiazine | C13H9N3S

10-(2-Propyn-1-yl)-10H-dipyrido[3,4-b:3',4'-e][1,4]thiazine

  • Molecular FormulaC13H9N3S
  • Average mass239.296 Da
  • Monoisotopic mass239.051712 Da
  • ChemSpider ID30657753

More details:

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

10-(2-Propin-1-yl)-10H-dipyrido[3,4-b:3',4'-e][1,4]thiazin [German] [ACD/IUPAC Name]
10-(2-Propyn-1-yl)-10H-dipyrido[3,4-b:3',4'-e][1,4]thiazine [ACD/IUPAC Name]
10-(2-Propyn-1-yl)-10H-dipyrido[3,4-b:3',4'-e][1,4]thiazine [French] [ACD/IUPAC Name]
10H-Dipyrido[3,4-b:3',4'-e][1,4]thiazine, 10-(2-propyn-1-yl)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 424.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.9±3.0 kJ/mol
Flash Point: 210.6±28.7 °C
Index of Refraction: 1.687
Molar Refractivity: 68.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.65
ACD/LogD (pH 5.5): 2.25
ACD/BCF (pH 5.5): 30.37
ACD/KOC (pH 5.5): 400.51
ACD/LogD (pH 7.4): 2.25
ACD/BCF (pH 7.4): 30.41
ACD/KOC (pH 7.4): 401.03
Polar Surface Area: 54 Å2
Polarizability: 27.3±0.5 10-24cm3
Surface Tension: 65.1±3.0 dyne/cm
Molar Volume: 180.9±3.0 cm3

Click to predict properties on the Chemicalize site


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