ChemSpider 2D Image | 2-Amino-4,5-bis((4-methoxybenzyl)oxy)benzoic acid | C23H23NO6

2-Amino-4,5-bis((4-methoxybenzyl)oxy)benzoic acid

  • Molecular FormulaC23H23NO6
  • Average mass409.432 Da
  • Monoisotopic mass409.152527 Da
  • ChemSpider ID32055283

More details:

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

1609073-29-1 [RN]
2-Amino-4,5-bis((4-methoxybenzyl)oxy)benzoic acid
2-Amino-4,5-bis[(4-methoxybenzyl)oxy]benzoesäure [German] [ACD/IUPAC Name]
2-Amino-4,5-bis[(4-methoxybenzyl)oxy]benzoic acid [ACD/IUPAC Name]
Acide 2-amino-4,5-bis[(4-méthoxybenzyl)oxy]benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-amino-4,5-bis[(4-methoxyphenyl)methoxy]- [ACD/Index Name]
2-amino-4,5-bis-(4-methoxybenzyloxy)benzoic acid
2-Amino-4,5-bis-(4-methoxy-benzyloxy)-benzoic acid
2-amino-4,5-bis[(4-methoxyphenyl)methoxy]benzoic acid
DS-9703
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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: 610.7±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 95.4±3.0 kJ/mol
    Flash Point: 323.1±31.5 °C
    Index of Refraction: 1.621
    Molar Refractivity: 113.1±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 3
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: 4.32
    ACD/LogD (pH 5.5): 3.61
    ACD/BCF (pH 5.5): 187.56
    ACD/KOC (pH 5.5): 768.31
    ACD/LogD (pH 7.4): 1.93
    ACD/BCF (pH 7.4): 3.98
    ACD/KOC (pH 7.4): 16.30
    Polar Surface Area: 100 Å2
    Polarizability: 44.8±0.5 10-24cm3
    Surface Tension: 52.6±3.0 dyne/cm
    Molar Volume: 321.7±3.0 cm3

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