ChemSpider 2D Image | (2E)-2-(4-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}benzylidene)-5,6-dimethoxy-1-indanone | C24H17ClF3NO4

(2E)-2-(4-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}benzylidene)-5,6-dimethoxy-1-indanone

  • Molecular FormulaC24H17ClF3NO4
  • Average mass475.844 Da
  • Monoisotopic mass475.079834 Da
  • ChemSpider ID26951797

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-2-(4-{[3-Chlor-5-(trifluormethyl)-2-pyridinyl]oxy}benzyliden)-5,6-dimethoxy-1-indanon [German] [ACD/IUPAC Name]
(2E)-2-(4-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}benzylidene)-5,6-dimethoxy-1-indanone [ACD/IUPAC Name]
(2E)-2-(4-{[3-Chloro-5-(trifluorométhyl)-2-pyridinyl]oxy}benzylidène)-5,6-diméthoxy-1-indanone [French] [ACD/IUPAC Name]
1H-Inden-1-one, 2-[[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]methylene]-2,3-dihydro-5,6-dimethoxy-, (2E)- [ACD/Index Name]
2-((4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYLOXY))PHENYL)METHYLENE)-5,6-DIMETHOXYINDAN-1-ONE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 577.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.4±3.0 kJ/mol
Flash Point: 303.0±30.1 °C
Index of Refraction: 1.604
Molar Refractivity: 117.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.72
ACD/LogD (pH 5.5): 5.20
ACD/BCF (pH 5.5): 5319.33
ACD/KOC (pH 5.5): 16164.45
ACD/LogD (pH 7.4): 5.20
ACD/BCF (pH 7.4): 5319.33
ACD/KOC (pH 7.4): 16164.45
Polar Surface Area: 58 Å2
Polarizability: 46.4±0.5 10-24cm3
Surface Tension: 49.0±3.0 dyne/cm
Molar Volume: 340.1±3.0 cm3

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