ChemSpider 2D Image | 4-(5-Isopropyl-1,2,4-oxadiazol-3-yl)benzoic acid | C12H12N2O3

4-(5-Isopropyl-1,2,4-oxadiazol-3-yl)benzoic acid

  • Molecular FormulaC12H12N2O3
  • Average mass232.235 Da
  • Monoisotopic mass232.084793 Da
  • ChemSpider ID21612571

More details:

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

4-(5-Isopropyl-1,2,4-oxadiazol-3-yl)benzoesäure [German] [ACD/IUPAC Name]
4-(5-Isopropyl-1,2,4-oxadiazol-3-yl)benzoic acid [ACD/IUPAC Name]
4-[5-(1-Methylethyl)-1,2,4-oxadiazol-3-yl]benzoic acid
4-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]benzoic acid
915920-28-4 [RN]
Acide 4-(5-isopropyl-1,2,4-oxadiazol-3-yl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[5-(1-methylethyl)-1,2,4-oxadiazol-3-yl]- [ACD/Index Name]
[915920-28-4] [RN]
3-amino-2-(9H-fluoren-9-ylmethoxycarbonyl)-4-(3-thienyl)butanoic acid
4-(5-isopropyl-1,2,4-oxadiazol-3-yl)benzoicacid
More...

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

MFCD08691677 [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 411.0±47.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 69.9±3.0 kJ/mol
    Flash Point: 202.3±29.3 °C
    Index of Refraction: 1.561
    Molar Refractivity: 60.4±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.26
    ACD/LogD (pH 5.5): 0.74
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 6.39
    ACD/LogD (pH 7.4): -0.22
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 76 Å2
    Polarizability: 24.0±0.5 10-24cm3
    Surface Tension: 51.6±3.0 dyne/cm
    Molar Volume: 186.6±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement