ChemSpider 2D Image | 8-Bromo-5-isobutoxy-2,3,4,5-tetrahydro-1-benzoxepine | C14H19BrO2

8-Bromo-5-isobutoxy-2,3,4,5-tetrahydro-1-benzoxepine

  • Molecular FormulaC14H19BrO2
  • Average mass299.203 Da
  • Monoisotopic mass298.056824 Da
  • ChemSpider ID68012694

More details:

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

1-Benzoxepin, 8-bromo-2,3,4,5-tetrahydro-5-(2-methylpropoxy)- [ACD/Index Name]
8-Brom-5-isobutoxy-2,3,4,5-tetrahydro-1-benzoxepin [German] [ACD/IUPAC Name]
8-Bromo-5-isobutoxy-2,3,4,5-tetrahydro-1-benzoxepine [ACD/IUPAC Name]
8-Bromo-5-isobutoxy-2,3,4,5-tétrahydro-1-benzoxépine [French] [ACD/IUPAC Name]
2241140-19-0 [RN]
8-bromo-5-(2-methylpropoxy)-2,3,4,5-tetrahydro-1-benzoxepine
MFCD31735982

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

Density: 1.3±0.1 g/cm3
Boiling Point: 337.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.8±3.0 kJ/mol
Flash Point: 132.4±23.4 °C
Index of Refraction: 1.550
Molar Refractivity: 72.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.47
ACD/LogD (pH 5.5): 4.19
ACD/BCF (pH 5.5): 901.56
ACD/KOC (pH 5.5): 4537.19
ACD/LogD (pH 7.4): 4.19
ACD/BCF (pH 7.4): 901.56
ACD/KOC (pH 7.4): 4537.19
Polar Surface Area: 18 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 41.4±5.0 dyne/cm
Molar Volume: 228.9±5.0 cm3

Click to predict properties on the Chemicalize site


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