ChemSpider 2D Image | 2'-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-1,1'-binaphthalene-2-carboxylic acid | C26H23NO4

2'-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-1,1'-binaphthalene-2-carboxylic acid

  • Molecular FormulaC26H23NO4
  • Average mass413.465 Da
  • Monoisotopic mass413.162720 Da
  • ChemSpider ID30659289

More details:

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

[1,1'-Binaphthalene]-2-carboxylic acid, 2'-[[(1,1-dimethylethoxy)carbonyl]amino]- [ACD/Index Name]
2'-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-1,1'-binaphthalene-2-carboxylic acid [ACD/IUPAC Name]
2'-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-1,1'-binaphthalin-2-carbonsäure [German] [ACD/IUPAC Name]
Acide 2'-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)-1,1'-binaphtalène-2-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 521.7±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.7±3.0 kJ/mol
Flash Point: 269.3±26.8 °C
Index of Refraction: 1.685
Molar Refractivity: 123.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 6.24
ACD/LogD (pH 5.5): 4.84
ACD/BCF (pH 5.5): 1307.41
ACD/KOC (pH 5.5): 2396.78
ACD/LogD (pH 7.4): 3.32
ACD/BCF (pH 7.4): 39.15
ACD/KOC (pH 7.4): 71.77
Polar Surface Area: 76 Å2
Polarizability: 48.9±0.5 10-24cm3
Surface Tension: 56.2±3.0 dyne/cm
Molar Volume: 324.5±3.0 cm3

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