ChemSpider 2D Image | 2-{[(E)-{5-[(~2~H_3_)Methyloxy]-1-[4-(trifluoromethyl)phenyl]pentylidene}amino]oxy}ethanamine | C15H18D3F3N2O2

2-{[(E)-{5-[(2H3)Methyloxy]-1-[4-(trifluoromethyl)phenyl]pentylidene}amino]oxy}ethanamine

  • Molecular FormulaC15H18D3F3N2O2
  • Average mass321.353 Da
  • Monoisotopic mass321.174347 Da
  • ChemSpider ID110404770

  • Double-bond stereo - Double-bond stereo

    Non-standard isotope - Non-standard isotope

More details:

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

1-Pentanone, 5-(methyl-d3-oxy)-1-[4-(trifluoromethyl)phenyl]-, O-(2-aminoethyl)oxime, (1E)- [ACD/Index Name]
2-{[(E)-{5-[(2H3)Methyloxy]-1-[4-(trifluormethyl)phenyl]pentyliden}amino]oxy}ethanamin [German] [ACD/IUPAC Name]
2-{[(E)-{5-[(2H3)Methyloxy]-1-[4-(trifluoromethyl)phenyl]pentylidene}amino]oxy}ethanamine [ACD/IUPAC Name]
2-{[(E)-{5-[(2H3)Méthyloxy]-1-[4-(trifluorométhyl)phényl]pentylidène}amino]oxy}éthanamine [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 370.6±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.7±3.0 kJ/mol
Flash Point: 177.9±30.7 °C
Index of Refraction: 1.474
Molar Refractivity: 76.8±0.5 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.11
ACD/LogD (pH 5.5): 0.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.08
ACD/BCF (pH 7.4): 1.33
ACD/KOC (pH 7.4): 11.82
Polar Surface Area: 57 Å2
Polarizability: 30.5±0.5 10-24cm3
Surface Tension: 32.4±7.0 dyne/cm
Molar Volume: 273.3±7.0 cm3

Click to predict properties on the Chemicalize site


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