ChemSpider 2D Image | 1-(4-Chlorophenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone | C11H9ClN2OS

1-(4-Chlorophenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone

  • Molecular FormulaC11H9ClN2OS
  • Average mass252.720 Da
  • Monoisotopic mass252.012405 Da
  • ChemSpider ID30653892

More details:

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

1-(4-Chlorophenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanone [ACD/IUPAC Name]
1-(4-Chlorophényl)-2-(5-méthyl-1,3,4-thiadiazol-2-yl)éthanone [French] [ACD/IUPAC Name]
1-(4-Chlorphenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)ethanon [German] [ACD/IUPAC Name]
Ethanone, 1-(4-chlorophenyl)-2-(5-methyl-1,3,4-thiadiazol-2-yl)- [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: 444.0±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.2±3.0 kJ/mol
Flash Point: 222.3±23.2 °C
Index of Refraction: 1.617
Molar Refractivity: 65.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.19
ACD/LogD (pH 5.5): 2.51
ACD/BCF (pH 5.5): 47.94
ACD/KOC (pH 5.5): 555.51
ACD/LogD (pH 7.4): 2.51
ACD/BCF (pH 7.4): 47.94
ACD/KOC (pH 7.4): 555.51
Polar Surface Area: 71 Å2
Polarizability: 25.8±0.5 10-24cm3
Surface Tension: 56.6±3.0 dyne/cm
Molar Volume: 185.8±3.0 cm3

Click to predict properties on the Chemicalize site


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