ChemSpider 2D Image | N-Boc-N-methyl-5-chloroanthranilic acid | C13H16ClNO4

N-Boc-N-methyl-5-chloroanthranilic acid

  • Molecular FormulaC13H16ClNO4
  • Average mass285.723 Da
  • Monoisotopic mass285.076782 Da
  • ChemSpider ID21373680

More details:

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

2-[(tert-Butoxycarbonyl)(methyl)amino]-5-chlorobenzoic acid
5-Chlor-2-(methyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)benzoesäure [German] [ACD/IUPAC Name]
5-Chloro-2-(methyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)benzoic acid [ACD/IUPAC Name]
886362-04-5 [RN]
Acide 5-chloro-2-(méthyl{[(2-méthyl-2-propanyl)oxy]carbonyl}amino)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 5-chloro-2-[[(1,1-dimethylethoxy)carbonyl]methylamino]- [ACD/Index Name]
N-Boc-N-methyl-5-chloroanthranilic acid
2-((tert-Butoxycarbonyl)(methyl)amino)-5-chlorobenzoic acid
2-(tert-Butoxycarbonyl-methyl-amino)-5-chloro-benzoic acid
2-(TERT-BUTOXYCARBONYL-METHYL-AMINO)-5-CHLOROBENZOIC ACID
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 402.4±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.9±3.0 kJ/mol
    Flash Point: 197.1±25.9 °C
    Index of Refraction: 1.570
    Molar Refractivity: 72.7±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.05
    ACD/LogD (pH 5.5): 1.59
    ACD/BCF (pH 5.5): 2.93
    ACD/KOC (pH 5.5): 18.78
    ACD/LogD (pH 7.4): 0.60
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.96
    Polar Surface Area: 67 Å2
    Polarizability: 28.8±0.5 10-24cm3
    Surface Tension: 49.1±3.0 dyne/cm
    Molar Volume: 221.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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