ChemSpider 2D Image | Methyl (2E)-{2-[(3-{[3,5-bis(trifluoromethyl)benzyl]oxy}phenoxy)methyl]phenyl}(methoxyimino)acetate | C26H21F6NO5

Methyl (2E)-{2-[(3-{[3,5-bis(trifluoromethyl)benzyl]oxy}phenoxy)methyl]phenyl}(methoxyimino)acetate

  • Molecular FormulaC26H21F6NO5
  • Average mass541.439 Da
  • Monoisotopic mass541.132385 Da
  • ChemSpider ID76765467

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-{2-[(3-{[3,5-Bis(trifluorométhyl)benzyl]oxy}phénoxy)méthyl]phényl}(méthoxyimino)acétate de méthyle [French] [ACD/IUPAC Name]
Benzeneacetic acid, 2-[[3-[[3,5-bis(trifluoromethyl)phenyl]methoxy]phenoxy]methyl]-α-(methoxyimino)-, methyl ester, (αE)- [ACD/Index Name]
Methyl (2E)-{2-[(3-{[3,5-bis(trifluoromethyl)benzyl]oxy}phenoxy)methyl]phenyl}(methoxyimino)acetate [ACD/IUPAC Name]
Methyl-(2E)-{2-[(3-{[3,5-bis(trifluormethyl)benzyl]oxy}phenoxy)methyl]phenyl}(methoxyimino)acetat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 527.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.2±3.0 kJ/mol
Flash Point: 272.8±32.9 °C
Index of Refraction: 1.504
Molar Refractivity: 124.1±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 6.76
ACD/LogD (pH 5.5): 6.41
ACD/BCF (pH 5.5): 44176.20
ACD/KOC (pH 5.5): 73554.39
ACD/LogD (pH 7.4): 6.41
ACD/BCF (pH 7.4): 44176.20
ACD/KOC (pH 7.4): 73554.39
Polar Surface Area: 66 Å2
Polarizability: 49.2±0.5 10-24cm3
Surface Tension: 33.9±7.0 dyne/cm
Molar Volume: 419.3±7.0 cm3

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