ChemSpider 2D Image | (4-Bromo-3-methylphenyl)(cyclopropyl)methanone | C11H11BrO

(4-Bromo-3-methylphenyl)(cyclopropyl)methanone

  • Molecular FormulaC11H11BrO
  • Average mass239.108 Da
  • Monoisotopic mass237.999313 Da
  • ChemSpider ID25659951

More details:






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

(4-Brom-3-methylphenyl)(cyclopropyl)methanon [German] [ACD/IUPAC Name]
(4-Bromo-3-methylphenyl)(cyclopropyl)methanone [ACD/IUPAC Name]
(4-Bromo-3-méthylphényl)(cyclopropyl)méthanone [French] [ACD/IUPAC Name]
1267167-02-1 [RN]
Methanone, (4-bromo-3-methylphenyl)cyclopropyl- [ACD/Index Name]
(4-bromo-3-methylphenyl)-cyclopropylmethanone
[1267167-02-1] [RN]
3-Phenyl-1H-pyrazole [ACD/IUPAC Name]
98%
MFCD19237231 [MDL number]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 329.3±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.2±3.0 kJ/mol
    Flash Point: 93.3±11.9 °C
    Index of Refraction: 1.604
    Molar Refractivity: 56.0±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.26
    ACD/LogD (pH 5.5): 3.18
    ACD/BCF (pH 5.5): 154.77
    ACD/KOC (pH 5.5): 1285.25
    ACD/LogD (pH 7.4): 3.18
    ACD/BCF (pH 7.4): 154.77
    ACD/KOC (pH 7.4): 1285.25
    Polar Surface Area: 17 Å2
    Polarizability: 22.2±0.5 10-24cm3
    Surface Tension: 47.8±3.0 dyne/cm
    Molar Volume: 162.7±3.0 cm3

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