ChemSpider 2D Image | MFCD20529482 | C13H10ClNO2

MFCD20529482

  • Molecular FormulaC13H10ClNO2
  • Average mass247.677 Da
  • Monoisotopic mass247.040009 Da
  • ChemSpider ID28535614

More details:

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

1352318-62-7 [RN]
3-(6-Chlor-2-methyl-3-pyridinyl)benzoesäure [German] [ACD/IUPAC Name]
3-(6-Chloro-2-methyl-3-pyridinyl)benzoic acid [ACD/IUPAC Name]
3-(6-CHLORO-2-METHYLPYRIDIN-3-YL)BENZOIC ACID
Acide 3-(6-chloro-2-méthyl-3-pyridinyl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-(6-chloro-2-methyl-3-pyridinyl)- [ACD/Index Name]
MFCD20529482
[1352318-62-7] [RN]
LD-0136

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 423.5±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 71.5±3.0 kJ/mol
    Flash Point: 209.9±28.7 °C
    Index of Refraction: 1.612
    Molar Refractivity: 65.6±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.63
    ACD/LogD (pH 5.5): 2.34
    ACD/BCF (pH 5.5): 15.15
    ACD/KOC (pH 5.5): 89.21
    ACD/LogD (pH 7.4): 0.91
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.29
    Polar Surface Area: 50 Å2
    Polarizability: 26.0±0.5 10-24cm3
    Surface Tension: 53.5±3.0 dyne/cm
    Molar Volume: 188.7±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement