ChemSpider 2D Image | 4-Bromo-1-methyl-2-(3-methylbutoxy)benzene | C12H17BrO

4-Bromo-1-methyl-2-(3-methylbutoxy)benzene

  • Molecular FormulaC12H17BrO
  • Average mass257.167 Da
  • Monoisotopic mass256.046265 Da
  • ChemSpider ID35328425

More details:

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

4-Brom-1-methyl-2-(3-methylbutoxy)benzol [German] [ACD/IUPAC Name]
4-Bromo-1-methyl-2-(3-methylbutoxy)benzene [ACD/IUPAC Name]
4-Bromo-1-méthyl-2-(3-méthylbutoxy)benzène [French] [ACD/IUPAC Name]
Benzene, 4-bromo-1-methyl-2-(3-methylbutoxy)- [ACD/Index Name]
1701750-87-9 [RN]
1-Bromo-4-methyl-3-iso-pentyloxybenzene
4-Bromo-2-(isopentyloxy)-1-methylbenzene
atoms 14 bonds 14
MFCD27952920

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

Density: 1.2±0.1 g/cm3
Boiling Point: 286.6±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 50.5±3.0 kJ/mol
Flash Point: 122.2±7.8 °C
Index of Refraction: 1.514
Molar Refractivity: 63.9±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.43
ACD/LogD (pH 5.5): 4.62
ACD/BCF (pH 5.5): 1898.48
ACD/KOC (pH 5.5): 7731.79
ACD/LogD (pH 7.4): 4.62
ACD/BCF (pH 7.4): 1898.48
ACD/KOC (pH 7.4): 7731.79
Polar Surface Area: 9 Å2
Polarizability: 25.3±0.5 10-24cm3
Surface Tension: 32.9±3.0 dyne/cm
Molar Volume: 212.3±3.0 cm3

Click to predict properties on the Chemicalize site


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