ChemSpider 2D Image | 3'-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-2-biphenylcarboxylic acid | C18H19NO4

3'-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-2-biphenylcarboxylic acid

  • Molecular FormulaC18H19NO4
  • Average mass313.348 Da
  • Monoisotopic mass313.131409 Da
  • ChemSpider ID26525913

More details:

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

[1,1'-Biphenyl]-2-carboxylic acid, 3'-[[(1,1-dimethylethoxy)carbonyl]amino]- [ACD/Index Name]
3'-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-2-biphenylcarbonsäure [German] [ACD/IUPAC Name]
3'-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-2-biphenylcarboxylic acid [ACD/IUPAC Name]
927801-48-7 [RN]
Acide 3'-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)-2-biphénylcarboxylique [French] [ACD/IUPAC Name]
[927801-48-7] [RN]
2-(3-BOC-Aminophenyl)benzoic acid
2-(3-BOC-Aminophenyl)benzoicacid
3-((tert-butoxycarbonyl)amino)-[1,1-biphenyl]-2-carboxylic acid
3'-((tert-Butoxycarbonyl)amino)-[1,1'-biphenyl]-2-carboxylic acid
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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: 1.2±0.1 g/cm3
    Boiling Point: 429.5±28.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 72.2±3.0 kJ/mol
    Flash Point: 213.5±24.0 °C
    Index of Refraction: 1.600
    Molar Refractivity: 87.7±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.78
    ACD/LogD (pH 5.5): 2.25
    ACD/BCF (pH 5.5): 12.24
    ACD/KOC (pH 5.5): 71.36
    ACD/LogD (pH 7.4): 0.89
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.11
    Polar Surface Area: 76 Å2
    Polarizability: 34.8±0.5 10-24cm3
    Surface Tension: 49.8±3.0 dyne/cm
    Molar Volume: 256.3±3.0 cm3

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