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Search term: MF = 'C_{12}H_{8}ClNO_{2}'
ChemSpider 2D Image | 6-(3-Chlorophenyl)nicotinic acid | C12H8ClNO2

6-(3-Chlorophenyl)nicotinic acid

  • Molecular FormulaC12H8ClNO2
  • Average mass233.650 Da
  • Monoisotopic mass233.024353 Da
  • ChemSpider ID21540826

More details:

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

3-Pyridinecarboxylic acid, 6-(3-chlorophenyl)- [ACD/Index Name]
6-(3-Chlorophenyl)nicotinic acid [ACD/IUPAC Name]
6-(3-CHLOROPHENYL)PYRIDINE-3-CARBOXYLIC ACID
6-(3-Chlorphenyl)nicotinsäure [German] [ACD/IUPAC Name]
Acide 6-(3-chlorophényl)nicotinique [French] [ACD/IUPAC Name]
MFCD06410393 [MDL number]
[887976-19-4] [RN]
2-Ethoxycarbonylmethyl-3-oxo-piperazine-1-carboxylic acid tert-butyl ester
6-(3-chlorophenyl)-3-Pyridine carboxylic acid
6-(3-Chlorophenyl)-3-pyridinecarboxylic acid
More...

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 417.5±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 70.7±3.0 kJ/mol
    Flash Point: 206.3±25.9 °C
    Index of Refraction: 1.622
    Molar Refractivity: 60.8±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.71
    ACD/LogD (pH 5.5): 1.07
    ACD/BCF (pH 5.5): 1.22
    ACD/KOC (pH 5.5): 10.26
    ACD/LogD (pH 7.4): 0.06
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 50 Å2
    Polarizability: 24.1±0.5 10-24cm3
    Surface Tension: 56.5±3.0 dyne/cm
    Molar Volume: 172.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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