ChemSpider 2D Image | 4-{[3-(3-Fluoro-4-methoxyphenyl)-2-methylpropyl]amino}-2,2-dimethylbutanoic acid | C17H26FNO3

4-{[3-(3-Fluoro-4-methoxyphenyl)-2-methylpropyl]amino}-2,2-dimethylbutanoic acid

  • Molecular FormulaC17H26FNO3
  • Average mass311.392 Da
  • Monoisotopic mass311.189667 Da
  • ChemSpider ID58103501

More details:






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

4-{[3-(3-Fluor-4-methoxyphenyl)-2-methylpropyl]amino}-2,2-dimethylbutansäure [German] [ACD/IUPAC Name]
4-{[3-(3-Fluoro-4-methoxyphenyl)-2-methylpropyl]amino}-2,2-dimethylbutanoic acid [ACD/IUPAC Name]
Acide 4-{[3-(3-fluoro-4-méthoxyphényl)-2-méthylpropyl]amino}-2,2-diméthylbutanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 4-[[3-(3-fluoro-4-methoxyphenyl)-2-methylpropyl]amino]-2,2-dimethyl- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 451.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.9±3.0 kJ/mol
Flash Point: 227.0±28.7 °C
Index of Refraction: 1.503
Molar Refractivity: 84.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.62
ACD/LogD (pH 5.5): 0.61
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.58
ACD/LogD (pH 7.4): 0.64
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.83
Polar Surface Area: 59 Å2
Polarizability: 33.5±0.5 10-24cm3
Surface Tension: 37.4±3.0 dyne/cm
Molar Volume: 286.4±3.0 cm3

Click to predict properties on the Chemicalize site






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