ChemSpider 2D Image | (5-Hydroxy-6-methyl-4-{(E)-[({[2-(trifluoromethyl)benzoyl]amino}acetyl)hydrazono]methyl}-3-pyridinyl)methyl dihydrogen phosphate | C18H18F3N4O7P

(5-Hydroxy-6-methyl-4-{(E)-[({[2-(trifluoromethyl)benzoyl]amino}acetyl)hydrazono]methyl}-3-pyridinyl)methyl dihydrogen phosphate

  • Molecular FormulaC18H18F3N4O7P
  • Average mass490.327 Da
  • Monoisotopic mass490.086517 Da
  • ChemSpider ID22377928

  • Double-bond stereo - Double-bond stereo

More details:

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

(5-Hydroxy-6-methyl-4-{(E)-[({[2-(trifluormethyl)benzoyl]amino}acetyl)hydrazono]methyl}-3-pyridinyl)methyldihydrogenphosphat [German] [ACD/IUPAC Name]
(5-Hydroxy-6-methyl-4-{(E)-[({[2-(trifluoromethyl)benzoyl]amino}acetyl)hydrazono]methyl}-3-pyridinyl)methyl dihydrogen phosphate [ACD/IUPAC Name]
Dihydrogénophosphate de (5-hydroxy-6-méthyl-4-{(E)-[(2-{[2-(trifluorométhyl)benzoyl]amino}acétyl)hydrazono]méthyl}-3-pyridinyl)méthyle [French] [ACD/IUPAC Name]
Phosphoric Acid Mono-(5-Hydroxy-6-Methyl-4-{[2-(2-Trifluoromethyl-Benzoylamino)-Acetyl]-Hydrazonomethyl}-Pyridin-3-Ylmethyl)ester

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.605
Molar Refractivity: 105.9±0.5 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 1.56
ACD/LogD (pH 5.5): -3.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 180 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 58.8±7.0 dyne/cm
Molar Volume: 307.7±7.0 cm3

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