ChemSpider 2D Image | 3-Iodo-4-(isobutylamino)benzoic acid | C11H14INO2

3-Iodo-4-(isobutylamino)benzoic acid

  • Molecular FormulaC11H14INO2
  • Average mass319.139 Da
  • Monoisotopic mass319.006927 Da
  • ChemSpider ID23960095

More details:

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

3-Iod-4-(isobutylamino)benzoesäure [German] [ACD/IUPAC Name]
3-Iodo-4-(isobutylamino)benzoic acid [ACD/IUPAC Name]
Acide 3-iodo-4-(isobutylamino)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-iodo-4-[(2-methylpropyl)amino]- [ACD/Index Name]
(1R,5S,6S)-2-((1-(4,5-dihydrothiazol-2-yl)azetidin-3-yl)thio)-6-((R)-1-hydroxyethyl)-1-methyl-6-(4-nitrobenzyl)-7-oxobicyclo[3.2.0]hept-2-ene-3-carboxylic acid
1131614-01-1 [RN]
3-iodanyl-4-(2-methylpropylamino)benzoic acid
3-iodo-4-(2-methylpropylamino)benzoic acid
3-iodo-4-(isobutylamino)benzoicacid
3-iodo-4-[(2-methylpropyl)amino]benzoic acid
More...

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 404.2±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 69.1±3.0 kJ/mol
    Flash Point: 198.2±27.3 °C
    Index of Refraction: 1.639
    Molar Refractivity: 69.6±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.24
    ACD/LogD (pH 5.5): 2.60
    ACD/BCF (pH 5.5): 31.38
    ACD/KOC (pH 5.5): 207.91
    ACD/LogD (pH 7.4): 0.93
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 4.46
    Polar Surface Area: 49 Å2
    Polarizability: 27.6±0.5 10-24cm3
    Surface Tension: 52.5±3.0 dyne/cm
    Molar Volume: 193.4±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement