ChemSpider 2D Image | (E)-1-(4-Chlorophenyl)-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]methanimine | C16H12ClN3S

(E)-1-(4-Chlorophenyl)-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]methanimine

  • Molecular FormulaC16H12ClN3S
  • Average mass313.805 Da
  • Monoisotopic mass313.044037 Da
  • ChemSpider ID30656582

  • Double-bond stereo - Double-bond stereo

More details:

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

(E)-1-(4-Chlorophenyl)-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]methanimine [ACD/IUPAC Name]
(E)-1-(4-Chlorophényl)-N-[5-(4-méthylphényl)-1,3,4-thiadiazol-2-yl]méthanimine [French] [ACD/IUPAC Name]
(E)-1-(4-Chlorphenyl)-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]methanimin [German] [ACD/IUPAC Name]
1,3,4-Thiadiazol-2-amine, N-[(1E)-(4-chlorophenyl)methylene]-5-(4-methylphenyl)- [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: 472.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.8±3.0 kJ/mol
Flash Point: 239.7±31.5 °C
Index of Refraction: 1.667
Molar Refractivity: 90.0±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.85
ACD/LogD (pH 5.5): 4.84
ACD/BCF (pH 5.5): 2799.23
ACD/KOC (pH 5.5): 10205.71
ACD/LogD (pH 7.4): 4.84
ACD/BCF (pH 7.4): 2802.40
ACD/KOC (pH 7.4): 10217.29
Polar Surface Area: 66 Å2
Polarizability: 35.7±0.5 10-24cm3
Surface Tension: 48.5±7.0 dyne/cm
Molar Volume: 241.7±7.0 cm3

Click to predict properties on the Chemicalize site


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