ChemSpider 2D Image | 1-(4-{(Z)-[(5S)-5-Ethoxydihydro-3(2H)-furanylidene]methyl}phenyl)-3-[(1R)-1-(1-naphthyl)ethyl]urea | C26H28N2O3

1-(4-{(Z)-[(5S)-5-Ethoxydihydro-3(2H)-furanylidene]methyl}phenyl)-3-[(1R)-1-(1-naphthyl)ethyl]urea

  • Molecular FormulaC26H28N2O3
  • Average mass416.512 Da
  • Monoisotopic mass416.209991 Da
  • ChemSpider ID30658931

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-(4-{(Z)-[(5S)-5-Ethoxydihydro-3(2H)-furanyliden]methyl}phenyl)-3-[(1R)-1-(1-naphthyl)ethyl]harnstoff [German] [ACD/IUPAC Name]
1-(4-{(Z)-[(5S)-5-Ethoxydihydro-3(2H)-furanylidene]methyl}phenyl)-3-[(1R)-1-(1-naphthyl)ethyl]urea [ACD/IUPAC Name]
1-(4-{(Z)-[(5S)-5-Éthoxydihydro-3(2H)-furanylidène]méthyl}phényl)-3-[(1R)-1-(1-naphtyl)éthyl]urée [French] [ACD/IUPAC Name]
Urea, N-[4-[(Z)-[(5S)-5-ethoxydihydro-3(2H)-furanylidene]methyl]phenyl]-N'-[(1R)-1-(1-naphthalenyl)ethyl]- [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: 593.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.5±3.0 kJ/mol
Flash Point: 312.9±30.1 °C
Index of Refraction: 1.635
Molar Refractivity: 123.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.36
ACD/LogD (pH 5.5): 4.78
ACD/BCF (pH 5.5): 2538.71
ACD/KOC (pH 5.5): 9519.58
ACD/LogD (pH 7.4): 4.78
ACD/BCF (pH 7.4): 2538.59
ACD/KOC (pH 7.4): 9519.14
Polar Surface Area: 60 Å2
Polarizability: 49.1±0.5 10-24cm3
Surface Tension: 53.2±5.0 dyne/cm
Molar Volume: 345.8±5.0 cm3

Click to predict properties on the Chemicalize site


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