ChemSpider 2D Image | 2-{[4-Chloro-2-(trifluoromethyl)phenyl]amino}-2-oxoethyl (4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetate | C18H12ClF3N4O4

2-{[4-Chloro-2-(trifluoromethyl)phenyl]amino}-2-oxoethyl (4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetate

  • Molecular FormulaC18H12ClF3N4O4
  • Average mass440.760 Da
  • Monoisotopic mass440.049927 Da
  • ChemSpider ID33198486

More details:

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

(4-Oxo-1,2,3-benzotriazin-3(4H)-yl)acétate de 2-{[4-chloro-2-(trifluorométhyl)phényl]amino}-2-oxoéthyle [French] [ACD/IUPAC Name]
1,2,3-Benzotriazine-3(4H)-acetic acid, 4-oxo-, 2-[[4-chloro-2-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester [ACD/Index Name]
2-{[4-Chlor-2-(trifluormethyl)phenyl]amino}-2-oxoethyl-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetat [German] [ACD/IUPAC Name]
2-{[4-Chloro-2-(trifluoromethyl)phenyl]amino}-2-oxoethyl (4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetate [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.621
Molar Refractivity: 99.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.29
ACD/LogD (pH 5.5): 3.29
ACD/BCF (pH 5.5): 185.76
ACD/KOC (pH 5.5): 1464.61
ACD/LogD (pH 7.4): 3.29
ACD/BCF (pH 7.4): 185.71
ACD/KOC (pH 7.4): 1464.18
Polar Surface Area: 100 Å2
Polarizability: 39.5±0.5 10-24cm3
Surface Tension: 51.5±7.0 dyne/cm
Molar Volume: 283.3±7.0 cm3

Click to predict properties on the Chemicalize site


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