ChemSpider 2D Image | tert-Butyl 2-(3-iodo-1H-indazol-1-yl)acetate | C13H15IN2O2

tert-Butyl 2-(3-iodo-1H-indazol-1-yl)acetate

  • Molecular FormulaC13H15IN2O2
  • Average mass358.175 Da
  • Monoisotopic mass358.017822 Da
  • ChemSpider ID35514099

More details:

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

(3-Iodo-1H-indazol-1-yl)acétate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1279833-53-2 [RN]
1H-Indazole-1-acetic acid, 3-iodo-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl (3-iodo-1H-indazol-1-yl)acetate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(3-iod-1H-indazol-1-yl)acetat [German] [ACD/IUPAC Name]
tert-Butyl 2-(3-iodo-1H-indazol-1-yl)acetate
(3-Iodo-indazol-1-yl)-acetic acid tert-butyl ester
MFCD28398638
tert-butyl 2-(3-iodoindazol-1-yl)acetate

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 408.5±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.0±3.0 kJ/mol
    Flash Point: 200.8±23.2 °C
    Index of Refraction: 1.624
    Molar Refractivity: 79.2±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.37
    ACD/LogD (pH 5.5): 3.67
    ACD/BCF (pH 5.5): 360.28
    ACD/KOC (pH 5.5): 2353.16
    ACD/LogD (pH 7.4): 3.67
    ACD/BCF (pH 7.4): 360.28
    ACD/KOC (pH 7.4): 2353.16
    Polar Surface Area: 44 Å2
    Polarizability: 31.4±0.5 10-24cm3
    Surface Tension: 44.7±7.0 dyne/cm
    Molar Volume: 224.6±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement