ChemSpider 2D Image | N-[4-Chloro-3-(trifluoromethyl)phenyl]-N~2~-methyl-N~2~-[(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetyl]glycinamide | C20H17ClF3N3O4

N-[4-Chloro-3-(trifluoromethyl)phenyl]-N2-methyl-N2-[(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetyl]glycinamide

  • Molecular FormulaC20H17ClF3N3O4
  • Average mass455.815 Da
  • Monoisotopic mass455.085968 Da
  • ChemSpider ID21693317

More details:

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

4H-1,4-Benzoxazine-4-acetamide, N-[2-[[4-chloro-3-(trifluoromethyl)phenyl]amino]-2-oxoethyl]-2,3-dihydro-N-methyl-3-oxo- [ACD/Index Name]
N-[4-Chlor-3-(trifluormethyl)phenyl]-N2-methyl-N2-[(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetyl]glycinamid [German] [ACD/IUPAC Name]
N-[4-Chloro-3-(trifluoromethyl)phenyl]-N2-methyl-N2-[(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetyl]glycinamide [ACD/IUPAC Name]
N-[4-Chloro-3-(trifluorométhyl)phényl]-N2-méthyl-N2-[2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acétyl]glycinamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 690.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.2±3.0 kJ/mol
Flash Point: 371.2±31.5 °C
Index of Refraction: 1.587
Molar Refractivity: 105.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.08
ACD/LogD (pH 5.5): 3.00
ACD/BCF (pH 5.5): 112.06
ACD/KOC (pH 5.5): 1019.97
ACD/LogD (pH 7.4): 3.00
ACD/BCF (pH 7.4): 112.05
ACD/KOC (pH 7.4): 1019.93
Polar Surface Area: 79 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 52.7±3.0 dyne/cm
Molar Volume: 312.8±3.0 cm3

Click to predict properties on the Chemicalize site


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