ChemSpider 2D Image | [(2-Oxo-2-{[3-(trifluoromethyl)benzyl]amino}ethyl)(phenyl)amino]acetic acid | C18H17F3N2O3

[(2-Oxo-2-{[3-(trifluoromethyl)benzyl]amino}ethyl)(phenyl)amino]acetic acid

  • Molecular FormulaC18H17F3N2O3
  • Average mass366.334 Da
  • Monoisotopic mass366.119141 Da
  • ChemSpider ID21800980

More details:

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

[(2-Oxo-2-{[3-(trifluormethyl)benzyl]amino}ethyl)(phenyl)amino]essigsäure [German] [ACD/IUPAC Name]
[(2-Oxo-2-{[3-(trifluoromethyl)benzyl]amino}ethyl)(phenyl)amino]acetic acid [ACD/IUPAC Name]
{PHENYL[({[3-(TRIFLUOROMETHYL)PHENYL]METHYL}CARBAMOYL)METHYL]AMINO}ACETIC ACID
1142205-11-5 [RN]
2-{PHENYL[({[3-(TRIFLUOROMETHYL)PHENYL]METHYL}CARBAMOYL)METHYL]AMINO}ACETIC ACID
Acetic acid, 2-[[2-oxo-2-[[[3-(trifluoromethyl)phenyl]methyl]amino]ethyl]phenylamino]- [ACD/Index Name]
Acide [(2-oxo-2-{[3-(trifluorométhyl)benzyl]amino}éthyl)(phényl)amino]acétique [French] [ACD/IUPAC Name]
[(2-OXO-2-([3-(TRIFLUOROMETHYL)BENZYL]AMINO)-ETHYL)(PHENYL)AMINO]ACETIC ACID
[(2-Oxo-2-{[3-(trifluoromethyl)benzyl]amino}-ethyl)(phenyl)amino]acetic acid
[(2-oxo-2-{[3-(trifluoromethyl)benzyl]amino}-ethyl)(phenyl)amino]aceticacid
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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: 562.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.0±3.0 kJ/mol
Flash Point: 294.1±30.1 °C
Index of Refraction: 1.570
Molar Refractivity: 89.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.78
ACD/LogD (pH 5.5): 1.64
ACD/BCF (pH 5.5): 5.24
ACD/KOC (pH 5.5): 51.12
ACD/LogD (pH 7.4): -0.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 70 Å2
Polarizability: 35.3±0.5 10-24cm3
Surface Tension: 47.4±3.0 dyne/cm
Molar Volume: 271.7±3.0 cm3

Click to predict properties on the Chemicalize site


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