ChemSpider 2D Image | 1-Bromo-2,2,4-trimethylpentane | C8H17Br

1-Bromo-2,2,4-trimethylpentane

  • Molecular FormulaC8H17Br
  • Average mass193.125 Da
  • Monoisotopic mass192.051361 Da
  • ChemSpider ID48220236

More details:

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

13356-11-1 [RN]
1-Brom-2,2,4-trimethylpentan [German] [ACD/IUPAC Name]
1-Bromo-2,2,4-trimethylpentane [ACD/IUPAC Name]
1-Bromo-2,2,4-triméthylpentane [French] [ACD/IUPAC Name]
2-(Bromomethyl)-2,4-dimethylpentane
Pentane, 1-bromo-2,2,4-trimethyl- [ACD/Index Name]
MFCD20625401

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 174.4±8.0 °C at 760 mmHg
    Vapour Pressure: 1.6±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 39.4±3.0 kJ/mol
    Flash Point: 48.5±13.6 °C
    Index of Refraction: 1.449
    Molar Refractivity: 46.8±0.3 cm3
    #H bond acceptors: 0
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 4.32
    ACD/LogD (pH 5.5): 3.79
    ACD/BCF (pH 5.5): 446.16
    ACD/KOC (pH 5.5): 2742.25
    ACD/LogD (pH 7.4): 3.79
    ACD/BCF (pH 7.4): 446.16
    ACD/KOC (pH 7.4): 2742.25
    Polar Surface Area: 0 Å2
    Polarizability: 18.5±0.5 10-24cm3
    Surface Tension: 26.5±3.0 dyne/cm
    Molar Volume: 174.2±3.0 cm3

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