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]
Acide 3'-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)-2-biphénylcarboxylique [French] [ACD/IUPAC Name]
2-(3-BOC-Aminophenyl)benzoic acid
3-((tert-butoxycarbonyl)amino)-[1,1-biphenyl]-2-carboxylic acid
3'-((tert-Butoxycarbonyl)amino)-[1,1'-biphenyl]-2-carboxylic acid

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

  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Appearance:

      Not Available Novochemy [NC-27011]
    • Safety:

      20/21/22 Novochemy [NC-27011]
      20/21/36/37/39 Novochemy [NC-27011]
      GHS07; GHS09 Novochemy [NC-27011]
      H332; H403 Novochemy [NC-27011]
      P301+P310; P337+P313 Novochemy [NC-27011]
      R52/53 Novochemy [NC-27011]
      Warning Novochemy [NC-27011]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

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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