ChemSpider 2D Image | (4R)-2-(2,6-Difluorophenyl)-4-[2-ethoxy-4-(2-methyl-2-propanyl)phenyl]-4,5-dihydro-1,3-oxazole | C21H23F2NO2

(4R)-2-(2,6-Difluorophenyl)-4-[2-ethoxy-4-(2-methyl-2-propanyl)phenyl]-4,5-dihydro-1,3-oxazole

  • Molecular FormulaC21H23F2NO2
  • Average mass359.410 Da
  • Monoisotopic mass359.169678 Da
  • ChemSpider ID32787794

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4R)-2-(2,6-Difluorophenyl)-4-[2-ethoxy-4-(2-methyl-2-propanyl)phenyl]-4,5-dihydro-1,3-oxazole [ACD/IUPAC Name]
(4R)-2-(2,6-Difluorophényl)-4-[2-éthoxy-4-(2-méthyl-2-propanyl)phényl]-4,5-dihydro-1,3-oxazole [French] [ACD/IUPAC Name]
(4R)-2-(2,6-Difluorphenyl)-4-[2-ethoxy-4-(2-methyl-2-propanyl)phenyl]-4,5-dihydro-1,3-oxazol [German] [ACD/IUPAC Name]
Oxazole, 2-(2,6-difluorophenyl)-4-[4-(1,1-dimethylethyl)-2-ethoxyphenyl]-4,5-dihydro-, (4R)- [ACD/Index Name]
153233-91-1 [RN]
etoxazole [BSI] [ISO]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 449.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.1±3.0 kJ/mol
Flash Point: 225.4±28.7 °C
Index of Refraction: 1.538
Molar Refractivity: 97.0±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.85
ACD/LogD (pH 5.5): 5.44
ACD/BCF (pH 5.5): 8006.47
ACD/KOC (pH 5.5): 21658.65
ACD/LogD (pH 7.4): 5.44
ACD/BCF (pH 7.4): 8009.20
ACD/KOC (pH 7.4): 21666.02
Polar Surface Area: 31 Å2
Polarizability: 38.5±0.5 10-24cm3
Surface Tension: 33.0±7.0 dyne/cm
Molar Volume: 310.4±7.0 cm3

Click to predict properties on the Chemicalize site


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