ChemSpider 2D Image | 2,4-Di-tert-butyl-5-nitrophenol | C14H21NO3

2,4-Di-tert-butyl-5-nitrophenol

  • Molecular FormulaC14H21NO3
  • Average mass251.321 Da
  • Monoisotopic mass251.152145 Da
  • ChemSpider ID21390539

More details:

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

2,4-Bis(2-methyl-2-propanyl)-5-nitrophenol [German] [ACD/IUPAC Name]
2,4-Bis(2-methyl-2-propanyl)-5-nitrophenol [ACD/IUPAC Name]
2,4-Bis(2-méthyl-2-propanyl)-5-nitrophénol [French] [ACD/IUPAC Name]
2,4-Di-tert-butyl-5-nitrophenol
873055-57-3 [RN]
MFCD11052606 [MDL number]
Phenol, 2,4-bis(1,1-dimethylethyl)-5-nitro- [ACD/Index Name]
[873055-57-3] [RN]
2,4-ditert-butyl-5-nitrophenol
2,4-Di-tert-butyl-5-nitro-phenol
More...

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 337.9±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.4±3.0 kJ/mol
    Flash Point: 133.6±16.3 °C
    Index of Refraction: 1.525
    Molar Refractivity: 71.5±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 1
    ACD/LogP: 5.30
    ACD/LogD (pH 5.5): 4.99
    ACD/BCF (pH 5.5): 3622.23
    ACD/KOC (pH 5.5): 12277.38
    ACD/LogD (pH 7.4): 4.99
    ACD/BCF (pH 7.4): 3614.17
    ACD/KOC (pH 7.4): 12250.06
    Polar Surface Area: 66 Å2
    Polarizability: 28.3±0.5 10-24cm3
    Surface Tension: 36.7±3.0 dyne/cm
    Molar Volume: 233.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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