ChemSpider 2D Image | 3-Acetamido-5-amino-2,4,6-triiodobenzoic acid | C9H7I3N2O3

3-Acetamido-5-amino-2,4,6-triiodobenzoic acid

  • Molecular FormulaC9H7I3N2O3
  • Average mass571.877 Da
  • Monoisotopic mass571.759033 Da
  • ChemSpider ID14819

More details:

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

1713-07-1 [RN]
216-987-8 [EINECS]
3-Acetamido-5-amino-2,4,6-triiodbenzoesäure [German] [ACD/IUPAC Name]
3-Acetamido-5-amino-2,4,6-triiodobenzoic acid [ACD/IUPAC Name]
3-Amino-5-acetylamino-2,4,6-triiodobenzoic acid
Acide 3-acétamido-5-amino-2,4,6-triiodobenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-(acetylamino)-5-amino-2,4,6-triiodo- [ACD/Index Name]
3-(acetylamino)-5-amino-2,4,6-triiodobenzoic acid
3-ACETYLAMINO-5-AMINO-2,4,6-TRIIODO-BENZOIC ACID
3-amino-5-acetamido-2,4,6-triiodobenzoate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

BRN 2753434 [DBID]

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

    Density: 2.8±0.1 g/cm3
    Boiling Point: 562.8±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 89.0±3.0 kJ/mol
    Flash Point: 294.2±30.1 °C
    Index of Refraction: 1.843
    Molar Refractivity: 90.4±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 4
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 1
    ACD/LogP: 1.10
    ACD/LogD (pH 5.5): -0.69
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.73
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 92 Å2
    Polarizability: 35.8±0.5 10-24cm3
    Surface Tension: 89.4±3.0 dyne/cm
    Molar Volume: 203.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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