ChemSpider 2D Image | Methyl 3-{(2-acetamidoethyl)[4-(trifluoromethyl)benzoyl]amino}-2-methylpropanoate | C17H21F3N2O4

Methyl 3-{(2-acetamidoethyl)[4-(trifluoromethyl)benzoyl]amino}-2-methylpropanoate

  • Molecular FormulaC17H21F3N2O4
  • Average mass374.355 Da
  • Monoisotopic mass374.145355 Da
  • ChemSpider ID27400059

More details:

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

3-{(2-Acétamidoéthyl)[4-(trifluorométhyl)benzoyl]amino}-2-méthylpropanoate de méthyle [French] [ACD/IUPAC Name]
METHYL 3-[N-(2-ACETAMIDOETHYL)-1-[4-(TRIFLUOROMETHYL)PHENYL]FORMAMIDO]-2-METHYLPROPANOATE
Methyl 3-{(2-acetamidoethyl)[4-(trifluoromethyl)benzoyl]amino}-2-methylpropanoate [ACD/IUPAC Name]
Methyl-3-{(2-acetamidoethyl)[4-(trifluormethyl)benzoyl]amino}-2-methylpropanoat [German] [ACD/IUPAC Name]
Propanoic acid, 3-[[2-(acetylamino)ethyl][4-(trifluoromethyl)benzoyl]amino]-2-methyl-, methyl ester [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 539.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.6±3.0 kJ/mol
Flash Point: 279.8±30.1 °C
Index of Refraction: 1.488
Molar Refractivity: 87.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.06
ACD/LogD (pH 5.5): 1.06
ACD/BCF (pH 5.5): 3.78
ACD/KOC (pH 5.5): 90.10
ACD/LogD (pH 7.4): 1.06
ACD/BCF (pH 7.4): 3.78
ACD/KOC (pH 7.4): 90.10
Polar Surface Area: 76 Å2
Polarizability: 34.6±0.5 10-24cm3
Surface Tension: 37.0±3.0 dyne/cm
Molar Volume: 303.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement