ChemSpider 2D Image | [{2-[(4-Fluorobenzyl)amino]-2-oxoethyl}(phenyl)amino]acetic acid | C17H17FN2O3

[{2-[(4-Fluorobenzyl)amino]-2-oxoethyl}(phenyl)amino]acetic acid

  • Molecular FormulaC17H17FN2O3
  • Average mass316.327 Da
  • Monoisotopic mass316.122314 Da
  • ChemSpider ID21800954

More details:

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

[({[(4-FLUOROPHENYL)METHYL]CARBAMOYL}METHYL)(PHENYL)AMINO]ACETIC ACID
[{2-[(4-Fluorbenzyl)amino]-2-oxoethyl}(phenyl)amino]essigsäure [German] [ACD/IUPAC Name]
[{2-[(4-Fluorobenzyl)amino]-2-oxoethyl}(phenyl)amino]acetic acid [ACD/IUPAC Name]
1142204-64-5 [RN]
2-[({[(4-FLUOROPHENYL)METHYL]CARBAMOYL}METHYL)(PHENYL)AMINO]ACETIC ACID
Acetic acid, 2-[[2-[[(4-fluorophenyl)methyl]amino]-2-oxoethyl]phenylamino]- [ACD/Index Name]
Acide [{2-[(4-fluorobenzyl)amino]-2-oxoéthyl}(phényl)amino]acétique [French] [ACD/IUPAC Name]
Glycine, N-[2-[[(4-fluorophenyl)methyl]amino]-2-oxoethyl]-N-phenyl-
[(2-[(4-FLUOROBENZYL)AMINO]-2-OXOETHYL)(PHENYL)-AMINO]ACETIC ACID
[{2-[(4-Fluorobenzyl)amino]-2-oxoethyl}(phenyl)-amino]acetic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 581.6±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 91.5±3.0 kJ/mol
    Flash Point: 305.5±30.1 °C
    Index of Refraction: 1.611
    Molar Refractivity: 84.1±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 2.26
    ACD/LogD (pH 5.5): 0.82
    ACD/BCF (pH 5.5): 1.25
    ACD/KOC (pH 5.5): 18.33
    ACD/LogD (pH 7.4): -0.96
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 70 Å2
    Polarizability: 33.4±0.5 10-24cm3
    Surface Tension: 55.9±3.0 dyne/cm
    Molar Volume: 242.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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