ChemSpider 2D Image | 3-(2-{2-[(2,4-Dinitrophenyl)amino]ethoxy}ethoxy)propanoic acid | C13H17N3O8

3-(2-{2-[(2,4-Dinitrophenyl)amino]ethoxy}ethoxy)propanoic acid

  • Molecular FormulaC13H17N3O8
  • Average mass343.289 Da
  • Monoisotopic mass343.101563 Da
  • ChemSpider ID29354612

More details:

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

3-(2-{2-[(2,4-Dinitrophenyl)amino]ethoxy}ethoxy)propanoic acid [ACD/IUPAC Name]
3-(2-{2-[(2,4-Dinitrophenyl)amino]ethoxy}ethoxy)propansäure [German] [ACD/IUPAC Name]
Acide 3-(2-{2-[(2,4-dinitrophényl)amino]éthoxy}éthoxy)propanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-[2-[2-[(2,4-dinitrophenyl)amino]ethoxy]ethoxy]- [ACD/Index Name]
1353011-89-8 [RN]
DNP-NH-PEG2-C2-acid
DNP-PEG2-acid
MFCD20926369
QA-3695

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 573.7±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 90.4±3.0 kJ/mol
    Flash Point: 300.8±30.1 °C
    Index of Refraction: 1.600
    Molar Refractivity: 81.8±0.3 cm3
    #H bond acceptors: 11
    #H bond donors: 2
    #Freely Rotating Bonds: 12
    #Rule of 5 Violations: 1
    ACD/LogP: 1.61
    ACD/LogD (pH 5.5): 0.56
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 12.94
    ACD/LogD (pH 7.4): -1.23
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 159 Å2
    Polarizability: 32.4±0.5 10-24cm3
    Surface Tension: 64.4±3.0 dyne/cm
    Molar Volume: 239.0±3.0 cm3

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