ChemSpider 2D Image | 3'-[(TERT-BUTOXYCARBONYL)AMINO]-1,1'-BIPHENYL-3-CARBOXYLIC ACID | C18H19NO4

3'-[(TERT-BUTOXYCARBONYL)AMINO]-1,1'-BIPHENYL-3-CARBOXYLIC ACID

  • Molecular FormulaC18H19NO4
  • Average mass313.348 Da
  • Monoisotopic mass313.131409 Da
  • ChemSpider ID28535840

More details:

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

[1,1'-Biphenyl]-3-carboxylic acid, 3'-[[(1,1-dimethylethoxy)carbonyl]amino]- [ACD/Index Name]
3'-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-3-biphenylcarbonsäure [German] [ACD/IUPAC Name]
3'-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-3-biphenylcarboxylic acid [ACD/IUPAC Name]
3'-[(TERT-BUTOXYCARBONYL)AMINO]-1,1'-BIPHENYL-3-CARBOXYLIC ACID
904086-01-7 [RN]
Acide 3'-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)-3-biphénylcarboxylique [French] [ACD/IUPAC Name]
[904086-01-7] [RN]
3'-((tert-Butoxycarbonyl)amino)-[1,1'-biphenyl]-3-carboxylic acid
3-(3-boc-aminophenyl)benzoic acid
3-(3-boc-aminophenyl)benzoicacid
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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: 463.4±38.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 76.3±3.0 kJ/mol
    Flash Point: 234.0±26.8 °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: 4.61
    ACD/LogD (pH 5.5): 2.80
    ACD/BCF (pH 5.5): 37.30
    ACD/KOC (pH 5.5): 189.30
    ACD/LogD (pH 7.4): 1.27
    ACD/BCF (pH 7.4): 1.10
    ACD/KOC (pH 7.4): 5.59
    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

    Click to predict properties on the Chemicalize site


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