ChemSpider 2D Image | N-{5-Fluoro-2-[(methylsulfonyl)methyl]benzyl}-6-(trifluoromethyl)-3-pyridazinamine | C14H13F4N3O2S

N-{5-Fluoro-2-[(methylsulfonyl)methyl]benzyl}-6-(trifluoromethyl)-3-pyridazinamine

  • Molecular FormulaC14H13F4N3O2S
  • Average mass363.331 Da
  • Monoisotopic mass363.066467 Da
  • ChemSpider ID70302392

More details:






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

3-Pyridazinamine, N-[[5-fluoro-2-[(methylsulfonyl)methyl]phenyl]methyl]-6-(trifluoromethyl)- [ACD/Index Name]
N-{5-Fluor-2-[(methylsulfonyl)methyl]benzyl}-6-(trifluormethyl)-3-pyridazinamin [German] [ACD/IUPAC Name]
N-{5-Fluoro-2-[(methylsulfonyl)methyl]benzyl}-6-(trifluoromethyl)-3-pyridazinamine [ACD/IUPAC Name]
N-{5-Fluoro-2-[(méthylsulfonyl)méthyl]benzyl}-6-(trifluorométhyl)-3-pyridazinamine [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 562.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.5±3.0 kJ/mol
Flash Point: 293.7±30.1 °C
Index of Refraction: 1.547
Molar Refractivity: 78.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.31
ACD/LogD (pH 5.5): 1.68
ACD/BCF (pH 5.5): 11.12
ACD/KOC (pH 5.5): 195.00
ACD/LogD (pH 7.4): 1.68
ACD/BCF (pH 7.4): 11.15
ACD/KOC (pH 7.4): 195.55
Polar Surface Area: 80 Å2
Polarizability: 31.1±0.5 10-24cm3
Surface Tension: 47.7±3.0 dyne/cm
Molar Volume: 247.6±3.0 cm3

Click to predict properties on the Chemicalize site






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