ChemSpider 2D Image | (E)-N-(5-Phenyl-1,3,4-thiadiazol-2-yl)-1-(2-thienyl)methanimine | C13H9N3S2

(E)-N-(5-Phenyl-1,3,4-thiadiazol-2-yl)-1-(2-thienyl)methanimine

  • Molecular FormulaC13H9N3S2
  • Average mass271.361 Da
  • Monoisotopic mass271.023773 Da
  • ChemSpider ID24742662
  • Double-bond stereo - Double-bond stereo


More details:






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

(E)-N-(5-Phenyl-1,3,4-thiadiazol-2-yl)-1-(2-thienyl)methanimin [German] [ACD/IUPAC Name]
(E)-N-(5-Phenyl-1,3,4-thiadiazol-2-yl)-1-(2-thienyl)methanimine [ACD/IUPAC Name]
(E)-N-(5-Phényl-1,3,4-thiadiazol-2-yl)-1-(2-thiényl)méthanimine [French] [ACD/IUPAC Name]
1,3,4-Thiadiazol-2-amine, 5-phenyl-N-[(1E)-2-thienylmethylene]- [ACD/Index 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: 454.4±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 68.7±3.0 kJ/mol
Flash Point: 228.6±26.5 °C
Index of Refraction: 1.729
Molar Refractivity: 79.6±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.23
ACD/LogD (pH 5.5): 3.61
ACD/BCF (pH 5.5): 328.73
ACD/KOC (pH 5.5): 2203.55
ACD/LogD (pH 7.4): 3.61
ACD/BCF (pH 7.4): 328.82
ACD/KOC (pH 7.4): 2204.14
Polar Surface Area: 95 Å2
Polarizability: 31.6±0.5 10-24cm3
Surface Tension: 57.8±7.0 dyne/cm
Molar Volume: 199.5±7.0 cm3

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