ChemSpider 2D Image | 3-{(Z)-[({1-[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl}acetyl)hydrazono]methyl}phenyl benzoate | C27H24ClF3N4O3

3-{(Z)-[({1-[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl}acetyl)hydrazono]methyl}phenyl benzoate

  • Molecular FormulaC27H24ClF3N4O3
  • Average mass544.953 Da
  • Monoisotopic mass544.148926 Da
  • ChemSpider ID101661960

  • Double-bond stereo - Double-bond stereo

More details:

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

3-{(Z)-[({1-[3-Chlor-5-(trifluormethyl)-2-pyridinyl]-4-piperidinyl}acetyl)hydrazono]methyl}phenyl-benzoat [German] [ACD/IUPAC Name]
3-{(Z)-[({1-[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl}acetyl)hydrazono]methyl}phenyl benzoate [ACD/IUPAC Name]
4-Piperidineacetic acid, 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-, 2-[(1Z)-[3-(benzoyloxy)phenyl]methylene]hydrazide [ACD/Index Name]
Benzoate de 3-{(Z)-[(2-{1-[3-chloro-5-(trifluorométhyl)-2-pyridinyl]-4-pipéridinyl}acétyl)hydrazono]méthyl}phényle [French] [ACD/IUPAC 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.601
Molar Refractivity: 137.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 8.05
ACD/LogD (pH 5.5): 6.66
ACD/BCF (pH 5.5): 67248.78
ACD/KOC (pH 5.5): 98568.94
ACD/LogD (pH 7.4): 6.67
ACD/BCF (pH 7.4): 69156.39
ACD/KOC (pH 7.4): 101364.99
Polar Surface Area: 84 Å2
Polarizability: 54.6±0.5 10-24cm3
Surface Tension: 45.9±7.0 dyne/cm
Molar Volume: 401.9±7.0 cm3

Click to predict properties on the Chemicalize site


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