ChemSpider 2D Image | (5E)-5-[Methoxy(phenyl)methylene]-1,3,4-triphenyl-4,5-dihydro-1H-1,2,4-triazole | C28H23N3O

(5E)-5-[Methoxy(phenyl)methylene]-1,3,4-triphenyl-4,5-dihydro-1H-1,2,4-triazole

  • Molecular FormulaC28H23N3O
  • Average mass417.502 Da
  • Monoisotopic mass417.184113 Da
  • ChemSpider ID30658242

  • Double-bond stereo - Double-bond stereo

More details:

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

(5E)-5-[Methoxy(phenyl)methylen]-1,3,4-triphenyl-4,5-dihydro-1H-1,2,4-triazol [German] [ACD/IUPAC Name]
(5E)-5-[Methoxy(phenyl)methylene]-1,3,4-triphenyl-4,5-dihydro-1H-1,2,4-triazole [ACD/IUPAC Name]
(5E)-5-[Méthoxy(phényl)méthylène]-1,3,4-triphényl-4,5-dihydro-1H-1,2,4-triazole [French] [ACD/IUPAC Name]
1H-1,2,4-Triazole, 4,5-dihydro-5-(methoxyphenylmethylene)-1,3,4-triphenyl-, (5E)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 552.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.3±3.0 kJ/mol
Flash Point: 287.8±32.9 °C
Index of Refraction: 1.621
Molar Refractivity: 131.0±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 6.11
ACD/LogD (pH 5.5): 4.15
ACD/BCF (pH 5.5): 310.38
ACD/KOC (pH 5.5): 654.98
ACD/LogD (pH 7.4): 5.47
ACD/BCF (pH 7.4): 6511.82
ACD/KOC (pH 7.4): 13741.69
Polar Surface Area: 28 Å2
Polarizability: 51.9±0.5 10-24cm3
Surface Tension: 44.4±7.0 dyne/cm
Molar Volume: 372.3±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement