Found 2169 results

Search term: MF = 'C_{11}H_{9}BrN_{2}O_{2}'
ChemSpider 2D Image | Methyl 3-(4-bromophenyl)-1H-pyrazole-4-carboxylate | C11H9BrN2O2

Methyl 3-(4-bromophenyl)-1H-pyrazole-4-carboxylate

  • Molecular FormulaC11H9BrN2O2
  • Average mass281.105 Da
  • Monoisotopic mass279.984741 Da
  • ChemSpider ID28293772

More details:

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

1150163-77-1 [RN]
1H-Pyrazole-4-carboxylic acid, 3-(4-bromophenyl)-, methyl ester [ACD/Index Name]
3-(4-Bromophényl)-1H-pyrazole-4-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 3-(4-bromophenyl)-1H-pyrazole-4-carboxylate [ACD/IUPAC Name]
Methyl-3-(4-bromphenyl)-1H-pyrazol-4-carboxylat [German] [ACD/IUPAC Name]
[1150163-77-1] [RN]
HC-2104
methyl 3-(4-bromophenyl)pyrazole-4-carboxylate
Methyl 5-(4-bromophenyl)-1H-pyrazole-4-carboxylate
Methyl3-(4-bromophenyl)-1H-pyrazole-4-carboxylate
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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: 1.6±0.1 g/cm3
    Boiling Point: 464.9±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 72.6±3.0 kJ/mol
    Flash Point: 234.9±25.9 °C
    Index of Refraction: 1.614
    Molar Refractivity: 62.8±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.23
    ACD/LogD (pH 5.5): 3.08
    ACD/BCF (pH 5.5): 129.94
    ACD/KOC (pH 5.5): 1134.01
    ACD/LogD (pH 7.4): 3.08
    ACD/BCF (pH 7.4): 129.81
    ACD/KOC (pH 7.4): 1132.88
    Polar Surface Area: 55 Å2
    Polarizability: 24.9±0.5 10-24cm3
    Surface Tension: 54.4±3.0 dyne/cm
    Molar Volume: 180.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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