ChemSpider 2D Image | 4-[Difluoro(3,4,5-trifluorophenoxy)methyl]-2',3,5-trifluoro-4''-propyl-1,1':4',1''-terphenyl | C28H18F8O

4-[Difluoro(3,4,5-trifluorophenoxy)methyl]-2',3,5-trifluoro-4''-propyl-1,1':4',1''-terphenyl

  • Molecular FormulaC28H18F8O
  • Average mass522.429 Da
  • Monoisotopic mass522.122986 Da
  • ChemSpider ID67865658

More details:

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

21569292 [Beilstein]
303186-36-9 [RN]
4-[Difluor(3,4,5-trifluorphenoxy)methyl]-2',3,5-trifluor-4''-propyl-1,1':4',1''-terphenyl [German] [ACD/IUPAC Name]
4-[Difluoro(3,4,5-trifluorophenoxy)methyl]-2',3,5-trifluoro-4''-propyl-1,1':4',1''-terphenyl [ACD/IUPAC Name]
4-[Difluoro(3,4,5-trifluorophénoxy)méthyl]-2',3,5-trifluoro-4''-propyl-1,1':4',1''-terphényl [French] [ACD/IUPAC Name]
Benzene, 5-[difluoro(2',3,5-trifluoro-4''-propyl[1,1':4',1''-terphenyl]-4-yl)methoxy]-1,2,3-trifluoro- [ACD/Index Name]
FR BF CF EOXFFR BF FF DR BF DR D3 [WLN]
4-(Difluoro(3,4,5-trifluorophenoxy)methyl)-2',3,5-trifluoro-4''-propyl-1,1':4',1''-terphenyl
4-[Difluoro(3,4,5-trifluorophenoxy)methyl]-2',3,5-trifluoro-
4'-[difluoro(3,4,5-trifluorophenoxy)methyl]-2,3',5'-trifluoro-4-(4-propylphenyl)-1,1'-biphenyl
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 531.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 77.7±3.0 kJ/mol
Flash Point: 285.8±26.0 °C
Index of Refraction: 1.529
Molar Refractivity: 120.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 10.55
ACD/LogD (pH 5.5): 8.97
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1811116.88
ACD/LogD (pH 7.4): 8.97
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1811116.88
Polar Surface Area: 9 Å2
Polarizability: 47.8±0.5 10-24cm3
Surface Tension: 35.3±3.0 dyne/cm
Molar Volume: 391.0±3.0 cm3

Click to predict properties on the Chemicalize site


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