ChemSpider 2D Image | 1-((tert-Butoxycarbonyl)amino)-4,4-difluorocyclohexanecarboxylic acid | C12H19F2NO4

1-((tert-Butoxycarbonyl)amino)-4,4-difluorocyclohexanecarboxylic acid

  • Molecular FormulaC12H19F2NO4
  • Average mass279.280 Da
  • Monoisotopic mass279.128204 Da
  • ChemSpider ID26549583

More details:

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

1-((tert-Butoxycarbonyl)amino)-4,4-difluorocyclohexanecarboxylic acid
1196151-58-2 [RN]
4,4-Difluor-1-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)cyclohexancarbonsäure [German] [ACD/IUPAC Name]
4,4-Difluoro-1-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)cyclohexanecarboxylic acid [ACD/IUPAC Name]
Acide 4,4-difluoro-1-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)cyclohexanecarboxylique [French] [ACD/IUPAC Name]
Cyclohexanecarboxylic acid, 1-[[(1,1-dimethylethoxy)carbonyl]amino]-4,4-difluoro- [ACD/Index Name]
1-(t-Butoxycarbonylamino)-4,4-difluorocyclohexanecarboxylic acid
1-(TERT-BUTOXYCARBONYLAMINO)-4,4-DIFLUOROCYCLOHEXANECARBOXYLIC ACID
1-[(tert-Butoxycarbonyl)amino]-4,4-difluorocyclohexane-1-carboxylic acid
1-{[(tert-butoxy)carbonyl]amino}-4,4-difluorocyclohexane-1-carboxylic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 394.0±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 70.7±6.0 kJ/mol
    Flash Point: 192.1±27.9 °C
    Index of Refraction: 1.472
    Molar Refractivity: 63.0±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.84
    ACD/LogD (pH 5.5): 0.19
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 5.44
    ACD/LogD (pH 7.4): -1.51
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 76 Å2
    Polarizability: 25.0±0.5 10-24cm3
    Surface Tension: 39.5±5.0 dyne/cm
    Molar Volume: 225.1±5.0 cm3

    Click to predict properties on the Chemicalize site


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