Found 169 results

Search term: MF = 'C_{9}H_{9}ClF_{3}N_{3}O'
ChemSpider 2D Image | 1-(6-Chloro-4-pyrimidinyl)-3-(trifluoromethyl)-3-pyrrolidinol | C9H9ClF3N3O

1-(6-Chloro-4-pyrimidinyl)-3-(trifluoromethyl)-3-pyrrolidinol

  • Molecular FormulaC9H9ClF3N3O
  • Average mass267.635 Da
  • Monoisotopic mass267.038635 Da
  • ChemSpider ID53613309

More details:

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

1-(6-Chlor-4-pyrimidinyl)-3-(trifluormethyl)-3-pyrrolidinol [German] [ACD/IUPAC Name]
1-(6-Chloro-4-pyrimidinyl)-3-(trifluoromethyl)-3-pyrrolidinol [ACD/IUPAC Name]
1-(6-Chloro-4-pyrimidinyl)-3-(trifluorométhyl)-3-pyrrolidinol [French] [ACD/IUPAC Name]
3-Pyrrolidinol, 1-(6-chloro-4-pyrimidinyl)-3-(trifluoromethyl)- [ACD/Index Name]
1-(6-chloropyrimidin-4-yl)-3-(trifluoromethyl)pyrrolidin-3-ol
1995627-22-9 [RN]
MFCD29997631

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 368.4±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.9±3.0 kJ/mol
    Flash Point: 176.6±27.9 °C
    Index of Refraction: 1.543
    Molar Refractivity: 53.8±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.25
    ACD/LogD (pH 5.5): 1.66
    ACD/BCF (pH 5.5): 10.74
    ACD/KOC (pH 5.5): 190.32
    ACD/LogD (pH 7.4): 1.66
    ACD/BCF (pH 7.4): 10.74
    ACD/KOC (pH 7.4): 190.38
    Polar Surface Area: 49 Å2
    Polarizability: 21.3±0.5 10-24cm3
    Surface Tension: 55.4±3.0 dyne/cm
    Molar Volume: 170.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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