ChemSpider 2D Image | 5-(3-Fluorobenzyl)-2-furoic acid | C12H9FO3

5-(3-Fluorobenzyl)-2-furoic acid

  • Molecular FormulaC12H9FO3
  • Average mass220.197 Da
  • Monoisotopic mass220.053574 Da
  • ChemSpider ID35486011

More details:

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

1399656-79-1 [RN]
2-Furancarboxylic acid, 5-[(3-fluorophenyl)methyl]- [ACD/Index Name]
5-(3-Fluorbenzyl)-2-furoesäure [German] [ACD/IUPAC Name]
5-(3-Fluorobenzyl)-2-furoic acid [ACD/IUPAC Name]
5-[(3-fluorophenyl)methyl]furan-2-carboxylic acid
Acide 5-(3-fluorobenzyl)-2-furoïque [French] [ACD/IUPAC Name]
5-(3-Fluorobenzyl)furan-2-carboxylic acid
5-(3-Fluoro-benzyl)-furan-2-carboxylic acid
AKOS023369717
MFCD22421136

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 356.5±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 63.5±3.0 kJ/mol
    Flash Point: 169.4±26.5 °C
    Index of Refraction: 1.564
    Molar Refractivity: 54.8±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.68
    ACD/LogD (pH 5.5): 1.00
    ACD/BCF (pH 5.5): 1.02
    ACD/KOC (pH 5.5): 8.48
    ACD/LogD (pH 7.4): 0.08
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.01
    Polar Surface Area: 50 Å2
    Polarizability: 21.7±0.5 10-24cm3
    Surface Tension: 47.3±3.0 dyne/cm
    Molar Volume: 168.4±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement