ChemSpider 2D Image | Methyl (2Z)-2-{[(2-fluorophenyl)amino]methylene}-3-oxobutanoate | C12H12FNO3

Methyl (2Z)-2-{[(2-fluorophenyl)amino]methylene}-3-oxobutanoate

  • Molecular FormulaC12H12FNO3
  • Average mass237.227 Da
  • Monoisotopic mass237.080124 Da
  • ChemSpider ID30654153

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-{[(2-Fluorophényl)amino]méthylène}-3-oxobutanoate de méthyle [French] [ACD/IUPAC Name]
Butanoic acid, 2-[[(2-fluorophenyl)amino]methylene]-3-oxo-, methyl ester, (2Z)- [ACD/Index Name]
Methyl (2Z)-2-{[(2-fluorophenyl)amino]methylene}-3-oxobutanoate [ACD/IUPAC Name]
Methyl-(2Z)-2-{[(2-fluorphenyl)amino]methylen}-3-oxobutanoat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 322.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.4±3.0 kJ/mol
Flash Point: 148.6±27.9 °C
Index of Refraction: 1.553
Molar Refractivity: 60.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.54
ACD/LogD (pH 5.5): 1.60
ACD/BCF (pH 5.5): 9.71
ACD/KOC (pH 5.5): 177.17
ACD/LogD (pH 7.4): 1.60
ACD/BCF (pH 7.4): 9.71
ACD/KOC (pH 7.4): 177.17
Polar Surface Area: 55 Å2
Polarizability: 24.1±0.5 10-24cm3
Surface Tension: 42.9±3.0 dyne/cm
Molar Volume: 189.7±3.0 cm3

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