ChemSpider 2D Image | 2-(5-(3-Bromophenyl)-1H-pyrazol-3-yl)phenol | C15H11BrN2O

2-(5-(3-Bromophenyl)-1H-pyrazol-3-yl)phenol

  • Molecular FormulaC15H11BrN2O
  • Average mass315.165 Da
  • Monoisotopic mass314.005463 Da
  • ChemSpider ID17760196

More details:

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

2-(5-(3-Bromophenyl)-1H-pyrazol-3-yl)phenol
2-[3-(3-bromophenyl)-1H-pyrazol-5-yl]phenol
2-[5-(3-Bromophenyl)-1H-pyrazol-3-yl]phenol [ACD/IUPAC Name]
2-[5-(3-Bromo-phenyl)-1H-pyrazol-3-yl]-phenol
2-[5-(3-Bromophényl)-1H-pyrazol-3-yl]phénol [French] [ACD/IUPAC Name]
2-[5-(3-bromophenyl)-2H-pyrazol-3-yl]phenol
2-[5-(3-Bromphenyl)-1H-pyrazol-3-yl]phenol [German] [ACD/IUPAC Name]
423751-80-8 [RN]
Phenol, 2-[5-(3-bromophenyl)-1H-pyrazol-3-yl]- [ACD/Index Name]
MFCD20502997 [MDL number]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 505.6±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 80.5±3.0 kJ/mol
    Flash Point: 259.6±27.3 °C
    Index of Refraction: 1.676
    Molar Refractivity: 77.5±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 4.06
    ACD/LogD (pH 5.5): 4.15
    ACD/BCF (pH 5.5): 839.21
    ACD/KOC (pH 5.5): 4309.67
    ACD/LogD (pH 7.4): 4.13
    ACD/BCF (pH 7.4): 809.53
    ACD/KOC (pH 7.4): 4157.23
    Polar Surface Area: 49 Å2
    Polarizability: 30.7±0.5 10-24cm3
    Surface Tension: 59.8±3.0 dyne/cm
    Molar Volume: 206.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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