ChemSpider 2D Image | 3-Fluoro-4-pyrrolidinobenzoic Acid | C11H12FNO2

3-Fluoro-4-pyrrolidinobenzoic Acid

  • Molecular FormulaC11H12FNO2
  • Average mass209.217 Da
  • Monoisotopic mass209.085205 Da
  • ChemSpider ID24063458

More details:

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

1021243-16-2 [RN]
3-Fluor-4-(1-pyrrolidinyl)benzoesäure [German] [ACD/IUPAC Name]
3-Fluoro-4-(1-pyrrolidinyl)benzoic acid [ACD/IUPAC Name]
3-fluoro-4-(pyrrolidin-1-yl)benzoic acid
3-Fluoro-4-pyrrolidinobenzoic Acid
Acide 3-fluoro-4-(1-pyrrolidinyl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-fluoro-4-(1-pyrrolidinyl)- [ACD/Index Name]
[1021243-16-2] [RN]
35276-83-6 [RN]
3-Fluoro-4-pyrrolidinobenzoicAcid
More...

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 369.0±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 65.0±3.0 kJ/mol
    Flash Point: 176.9±25.1 °C
    Index of Refraction: 1.579
    Molar Refractivity: 53.4±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.67
    ACD/LogD (pH 5.5): 1.46
    ACD/BCF (pH 5.5): 4.53
    ACD/KOC (pH 5.5): 56.29
    ACD/LogD (pH 7.4): -0.22
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.20
    Polar Surface Area: 41 Å2
    Polarizability: 21.2±0.5 10-24cm3
    Surface Tension: 50.6±3.0 dyne/cm
    Molar Volume: 160.7±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement