ChemSpider 2D Image | {2-[(4-Bromo-2,3,5,6-tetrafluorobenzyl)carbamoyl]-5-chlorophenoxy}acetic acid | C16H9BrClF4NO4

{2-[(4-Bromo-2,3,5,6-tetrafluorobenzyl)carbamoyl]-5-chlorophenoxy}acetic acid

  • Molecular FormulaC16H9BrClF4NO4
  • Average mass470.598 Da
  • Monoisotopic mass468.933960 Da
  • ChemSpider ID34955225

More details:

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

{2-[(4-Brom-2,3,5,6-tetrafluorbenzyl)carbamoyl]-5-chlorphenoxy}essigsäure [German] [ACD/IUPAC Name]
{2-[(4-Bromo-2,3,5,6-tetrafluorobenzyl)carbamoyl]-5-chlorophenoxy}acetic acid [ACD/IUPAC Name]
Acetic acid, 2-[2-[[[(4-bromo-2,3,5,6-tetrafluorophenyl)methyl]amino]carbonyl]-5-chlorophenoxy]- [ACD/Index Name]
Acide {2-[(4-bromo-2,3,5,6-tétrafluorobenzyl)carbamoyl]-5-chlorophénoxy}acétique [French] [ACD/IUPAC Name]
1462383-00-1 [RN]
1WX
MK319

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 549.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.2±3.0 kJ/mol
Flash Point: 285.9±30.1 °C
Index of Refraction: 1.578
Molar Refractivity: 89.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.78
ACD/LogD (pH 5.5): 1.13
ACD/BCF (pH 5.5): 1.03
ACD/KOC (pH 5.5): 6.65
ACD/LogD (pH 7.4): 0.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 76 Å2
Polarizability: 35.6±0.5 10-24cm3
Surface Tension: 51.7±3.0 dyne/cm
Molar Volume: 270.6±3.0 cm3

Click to predict properties on the Chemicalize site


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