ChemSpider 2D Image | Methyl 4-amino-5-iodo-2-methoxybenzoate | C9H10INO3

Methyl 4-amino-5-iodo-2-methoxybenzoate

  • Molecular FormulaC9H10INO3
  • Average mass307.085 Da
  • Monoisotopic mass306.970520 Da
  • ChemSpider ID23959992

More details:

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

137832-56-5 [RN]
4-Amino-5-iodo-2-méthoxybenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-amino-5-iodo-2-methoxy-, methyl ester [ACD/Index Name]
Methyl 4-amino-5-iodo-2-methoxybenzoate [ACD/IUPAC Name]
Methyl-4-amino-5-iod-2-methoxybenzoat [German] [ACD/IUPAC Name]
[137832-56-5] [RN]
3-Isoxazolecarboxylic acid [ACD/Index Name]
4-amino-5-iodo-2-methoxybenzoic acid methyl ester
4-Amino-5-iodo-2-methoxy-benzoic acid methyl ester
Isoxazole-3-carboxylic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.7±0.1 g/cm3
    Boiling Point: 414.0±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.7±3.0 kJ/mol
    Flash Point: 204.2±28.7 °C
    Index of Refraction: 1.622
    Molar Refractivity: 61.8±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.90
    ACD/LogD (pH 5.5): 2.58
    ACD/BCF (pH 5.5): 53.29
    ACD/KOC (pH 5.5): 599.18
    ACD/LogD (pH 7.4): 2.58
    ACD/BCF (pH 7.4): 53.29
    ACD/KOC (pH 7.4): 599.18
    Polar Surface Area: 62 Å2
    Polarizability: 24.5±0.5 10-24cm3
    Surface Tension: 51.3±3.0 dyne/cm
    Molar Volume: 175.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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