ChemSpider 2D Image | 3-{(E)-[(2-Heptanyloxy)imino]methyl}-2,4,6-trimethoxyphenyl 4-fluorobenzoate | C24H30FNO6

3-{(E)-[(2-Heptanyloxy)imino]methyl}-2,4,6-trimethoxyphenyl 4-fluorobenzoate

  • Molecular FormulaC24H30FNO6
  • Average mass447.496 Da
  • Monoisotopic mass447.205719 Da
  • ChemSpider ID74829010

  • Double-bond stereo - Double-bond stereo

More details:

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

3-{(E)-[(2-Heptanyloxy)imino]methyl}-2,4,6-trimethoxyphenyl 4-fluorobenzoate [ACD/IUPAC Name]
3-{(E)-[(2-Heptanyloxy)imino]methyl}-2,4,6-trimethoxyphenyl-4-fluorbenzoat [German] [ACD/IUPAC Name]
4-Fluorobenzoate de 3-{(E)-[(2-heptanyloxy)imino]méthyl}-2,4,6-triméthoxyphényle [French] [ACD/IUPAC Name]
Benzoic acid, 4-fluoro-, 2,4,6-trimethoxy-3-[(E)-[[(1-methylhexyl)oxy]imino]methyl]phenyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 578.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.6±3.0 kJ/mol
Flash Point: 303.6±32.9 °C
Index of Refraction: 1.509
Molar Refractivity: 117.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 6.74
ACD/LogD (pH 5.5): 6.44
ACD/BCF (pH 5.5): 45812.25
ACD/KOC (pH 5.5): 75494.09
ACD/LogD (pH 7.4): 6.44
ACD/BCF (pH 7.4): 45812.25
ACD/KOC (pH 7.4): 75494.09
Polar Surface Area: 76 Å2
Polarizability: 46.7±0.5 10-24cm3
Surface Tension: 34.3±7.0 dyne/cm
Molar Volume: 394.6±7.0 cm3

Click to predict properties on the Chemicalize site


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