ChemSpider 2D Image | (4R)-2-(2-Bromophenyl)-4-(2-methyl-2-propanyl)-4,5-dihydro-1,3-oxazole | C13H16BrNO

(4R)-2-(2-Bromophenyl)-4-(2-methyl-2-propanyl)-4,5-dihydro-1,3-oxazole

  • Molecular FormulaC13H16BrNO
  • Average mass282.176 Da
  • Monoisotopic mass281.041504 Da
  • ChemSpider ID92170305

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4R)-2-(2-Bromophenyl)-4-(2-methyl-2-propanyl)-4,5-dihydro-1,3-oxazole [ACD/IUPAC Name]
(4R)-2-(2-Bromophényl)-4-(2-méthyl-2-propanyl)-4,5-dihydro-1,3-oxazole [French] [ACD/IUPAC Name]
(4R)-2-(2-Bromphenyl)-4-(2-methyl-2-propanyl)-4,5-dihydro-1,3-oxazol [German] [ACD/IUPAC Name]
Oxazole, 2-(2-bromophenyl)-4-(1,1-dimethylethyl)-4,5-dihydro-, (4R)- [ACD/Index Name]
2375081-41-5 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 345.1±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.6±3.0 kJ/mol
Flash Point: 162.5±23.2 °C
Index of Refraction: 1.570
Molar Refractivity: 69.3±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.34
ACD/LogD (pH 5.5): 3.82
ACD/BCF (pH 5.5): 465.52
ACD/KOC (pH 5.5): 2806.84
ACD/LogD (pH 7.4): 3.83
ACD/BCF (pH 7.4): 477.17
ACD/KOC (pH 7.4): 2877.14
Polar Surface Area: 22 Å2
Polarizability: 27.5±0.5 10-24cm3
Surface Tension: 37.0±7.0 dyne/cm
Molar Volume: 211.4±7.0 cm3

Click to predict properties on the Chemicalize site


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