ChemSpider 2D Image | 3,6-Diamino-4-(2-chlorophenyl)thieno[2,3-b]pyridine-2,5-dicarbonitrile | C15H8ClN5S

3,6-Diamino-4-(2-chlorophenyl)thieno[2,3-b]pyridine-2,5-dicarbonitrile

  • Molecular FormulaC15H8ClN5S
  • Average mass325.776 Da
  • Monoisotopic mass325.018890 Da
  • ChemSpider ID29396882

More details:

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

3,6-Diamino-4-(2-chlorophenyl)thieno[2,3-b]pyridine-2,5-dicarbonitrile [ACD/IUPAC Name]
3,6-Diamino-4-(2-chlorophényl)thiéno[2,3-b]pyridine-2,5-dicarbonitrile [French] [ACD/IUPAC Name]
3,6-Diamino-4-(2-chlorphenyl)thieno[2,3-b]pyridin-2,5-dicarbonitril [German] [ACD/IUPAC Name]
Thieno[2,3-b]pyridine-2,5-dicarbonitrile, 3,6-diamino-4-(2-chlorophenyl)- [ACD/Index Name]
UGJ

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

Density: 1.6±0.1 g/cm3
Boiling Point: 669.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.4±3.0 kJ/mol
Flash Point: 358.6±31.5 °C
Index of Refraction: 1.788
Molar Refractivity: 86.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.61
ACD/LogD (pH 5.5): 3.06
ACD/BCF (pH 5.5): 125.21
ACD/KOC (pH 5.5): 1102.89
ACD/LogD (pH 7.4): 3.07
ACD/BCF (pH 7.4): 125.76
ACD/KOC (pH 7.4): 1107.80
Polar Surface Area: 141 Å2
Polarizability: 34.2±0.5 10-24cm3
Surface Tension: 104.3±5.0 dyne/cm
Molar Volume: 203.8±5.0 cm3

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