ChemSpider 2D Image | N''-[(E)-{5-[2-(Trifluoromethyl)phenyl]-2-thienyl}methylene]carbonohydrazonic diamide | C13H11F3N4S

N''-[(E)-{5-[2-(Trifluoromethyl)phenyl]-2-thienyl}methylene]carbonohydrazonic diamide

  • Molecular FormulaC13H11F3N4S
  • Average mass312.313 Da
  • Monoisotopic mass312.065643 Da
  • ChemSpider ID59719571

More details:

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

Carbonohydrazonic diamide, N''-[(1E)-[5-[2-(trifluoromethyl)phenyl]-2-thienyl]methylene]- [ACD/Index Name]
Diamide N''-[(E)-{5-[2-(trifluorométhyl)phényl]-2-thiényl}méthylène]carbonohydrazonique [French] [ACD/IUPAC Name]
N''-[(E)-{5-[2-(Trifluormethyl)phenyl]-2-thienyl}methylen]carbonohydrazondiamid [German] [ACD/IUPAC Name]
N''-[(E)-{5-[2-(Trifluoromethyl)phenyl]-2-thienyl}methylene]carbonohydrazonic diamide [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 473.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.7±3.0 kJ/mol
Flash Point: 240.2±31.5 °C
Index of Refraction: 1.612
Molar Refractivity: 75.3±0.5 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.56
ACD/LogD (pH 5.5): 1.60
ACD/BCF (pH 5.5): 3.40
ACD/KOC (pH 5.5): 24.34
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 53.20
ACD/KOC (pH 7.4): 380.75
Polar Surface Area: 105 Å2
Polarizability: 29.8±0.5 10-24cm3
Surface Tension: 46.6±7.0 dyne/cm
Molar Volume: 216.5±7.0 cm3

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