ChemSpider 2D Image | 4-(3-Bromopropyl)-3,5-dimethyl-1,2-oxazole | C8H12BrNO

4-(3-Bromopropyl)-3,5-dimethyl-1,2-oxazole

  • Molecular FormulaC8H12BrNO
  • Average mass218.091 Da
  • Monoisotopic mass217.010223 Da
  • ChemSpider ID58836196

More details:

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

4-(3-Bromopropyl)-3,5-dimethyl-1,2-oxazole [ACD/IUPAC Name]
4-(3-Bromopropyl)-3,5-diméthyl-1,2-oxazole [French] [ACD/IUPAC Name]
4-(3-Brompropyl)-3,5-dimethyl-1,2-oxazol [German] [ACD/IUPAC Name]
Isoxazole, 4-(3-bromopropyl)-3,5-dimethyl- [ACD/Index Name]
135510-62-2 [RN]
4-(3-Bromopropyl)-3,5-dimethylisoxazole
MFCD24462935

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

Density: 1.4±0.1 g/cm3
Boiling Point: 270.5±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.8±3.0 kJ/mol
Flash Point: 117.4±25.9 °C
Index of Refraction: 1.513
Molar Refractivity: 48.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.50
ACD/LogD (pH 5.5): 3.09
ACD/BCF (pH 5.5): 130.24
ACD/KOC (pH 5.5): 1135.93
ACD/LogD (pH 7.4): 3.09
ACD/BCF (pH 7.4): 130.24
ACD/KOC (pH 7.4): 1135.93
Polar Surface Area: 26 Å2
Polarizability: 19.1±0.5 10-24cm3
Surface Tension: 38.3±3.0 dyne/cm
Molar Volume: 160.5±3.0 cm3

Click to predict properties on the Chemicalize site


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