ChemSpider 2D Image | 2-[(2-Chloro-4-fluorophenyl)amino]-2-oxoethyl (3-bromophenoxy)acetate | C16H12BrClFNO4

2-[(2-Chloro-4-fluorophenyl)amino]-2-oxoethyl (3-bromophenoxy)acetate

  • Molecular FormulaC16H12BrClFNO4
  • Average mass416.626 Da
  • Monoisotopic mass414.962219 Da
  • ChemSpider ID22302910

More details:

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

(3-Bromophénoxy)acétate de 2-[(2-chloro-4-fluorophényl)amino]-2-oxoéthyle [French] [ACD/IUPAC Name]
2-[(2-Chlor-4-fluorphenyl)amino]-2-oxoethyl-(3-bromphenoxy)acetat [German] [ACD/IUPAC Name]
2-[(2-Chloro-4-fluorophenyl)amino]-2-oxoethyl (3-bromophenoxy)acetate [ACD/IUPAC Name]
Acetic acid, 2-(3-bromophenoxy)-, 2-[(2-chloro-4-fluorophenyl)amino]-2-oxoethyl ester [ACD/Index 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: 541.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.0±3.0 kJ/mol
Flash Point: 281.5±30.1 °C
Index of Refraction: 1.613
Molar Refractivity: 90.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.64
ACD/LogD (pH 5.5): 4.06
ACD/BCF (pH 5.5): 722.72
ACD/KOC (pH 5.5): 3873.03
ACD/LogD (pH 7.4): 4.06
ACD/BCF (pH 7.4): 722.26
ACD/KOC (pH 7.4): 3870.58
Polar Surface Area: 65 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 53.0±3.0 dyne/cm
Molar Volume: 259.8±3.0 cm3

Click to predict properties on the Chemicalize site


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