ChemSpider 2D Image | 4-{[1-(3-Fluorophenyl)-4-methoxy-2-butanyl]amino}-2,2-dimethylbutanoic acid | C17H26FNO3

4-{[1-(3-Fluorophenyl)-4-methoxy-2-butanyl]amino}-2,2-dimethylbutanoic acid

  • Molecular FormulaC17H26FNO3
  • Average mass311.392 Da
  • Monoisotopic mass311.189667 Da
  • ChemSpider ID58103412

More details:






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

4-{[1-(3-Fluorophenyl)-4-methoxy-2-butanyl]amino}-2,2-dimethylbutanoic acid [ACD/IUPAC Name]
4-{[1-(3-Fluorphenyl)-4-methoxy-2-butanyl]amino}-2,2-dimethylbutansäure [German] [ACD/IUPAC Name]
Acide 4-{[1-(3-fluorophényl)-4-méthoxy-2-butanyl]amino}-2,2-diméthylbutanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 4-[[1-[(3-fluorophenyl)methyl]-3-methoxypropyl]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: 444.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 74.0±3.0 kJ/mol
Flash Point: 222.7±28.7 °C
Index of Refraction: 1.503
Molar Refractivity: 84.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 1.99
ACD/LogD (pH 5.5): 0.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.82
ACD/LogD (pH 7.4): 0.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.93
Polar Surface Area: 59 Å2
Polarizability: 33.4±0.5 10-24cm3
Surface Tension: 38.6±3.0 dyne/cm
Molar Volume: 285.3±3.0 cm3

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