ChemSpider 2D Image | (2E)-1-(4,4''-Difluoro-5'-methoxy-1,1':3',1''-terphenyl-4'-yl)-3-(6-methoxy-2-naphthyl)-2-propen-1-one | C33H24F2O3

(2E)-1-(4,4''-Difluoro-5'-methoxy-1,1':3',1''-terphenyl-4'-yl)-3-(6-methoxy-2-naphthyl)-2-propen-1-one

  • Molecular FormulaC33H24F2O3
  • Average mass506.539 Da
  • Monoisotopic mass506.169342 Da
  • ChemSpider ID30657246

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-1-(4,4''-Difluor-5'-methoxy-1,1':3',1''-terphenyl-4'-yl)-3-(6-methoxy-2-naphthyl)-2-propen-1-on [German] [ACD/IUPAC Name]
(2E)-1-(4,4''-Difluoro-5'-methoxy-1,1':3',1''-terphenyl-4'-yl)-3-(6-methoxy-2-naphthyl)-2-propen-1-one [ACD/IUPAC Name]
(2E)-1-(4,4''-Difluoro-5'-méthoxy-1,1':3',1''-terphényl-4'-yl)-3-(6-méthoxy-2-naphtyl)-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 1-(4,4''-difluoro-5'-methoxy[1,1':3',1''-terphenyl]-4'-yl)-3-(6-methoxy-2-naphthalenyl)-, (2E)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 680.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.8±3.0 kJ/mol
Flash Point: 351.2±26.4 °C
Index of Refraction: 1.637
Molar Refractivity: 147.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 7.85
ACD/LogD (pH 5.5): 7.24
ACD/BCF (pH 5.5): 187310.25
ACD/KOC (pH 5.5): 206859.63
ACD/LogD (pH 7.4): 7.24
ACD/BCF (pH 7.4): 187310.25
ACD/KOC (pH 7.4): 206859.63
Polar Surface Area: 36 Å2
Polarizability: 58.5±0.5 10-24cm3
Surface Tension: 45.8±3.0 dyne/cm
Molar Volume: 410.9±3.0 cm3

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