ChemSpider 2D Image | METHYL 2-(4-CHLOROPYRIMIDIN-2-YLOXY)BENZOATE | C12H9ClN2O3

METHYL 2-(4-CHLOROPYRIMIDIN-2-YLOXY)BENZOATE

  • Molecular FormulaC12H9ClN2O3
  • Average mass264.664 Da
  • Monoisotopic mass264.030182 Da
  • ChemSpider ID24957827

More details:

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

1159822-80-6 [RN]
2-[(4-Chloro-2-pyrimidinyl)oxy]benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-[(4-chloro-2-pyrimidinyl)oxy]-, methyl ester [ACD/Index Name]
METHYL 2-(4-CHLOROPYRIMIDIN-2-YLOXY)BENZOATE
Methyl 2-[(4-chloro-2-pyrimidinyl)oxy]benzoate [ACD/IUPAC Name]
Methyl-2-[(4-chlor-2-pyrimidinyl)oxy]benzoat [German] [ACD/IUPAC Name]
2-(4-chloropyrimidin-2-yloxy)benzoic acid methyl ester
2-(4-chloropyrimidin-2-yloxy)-benzoic acid methyl ester
2-(4-chloro-pyrimidin-2-yloxy)-benzoic acid methyl ester
3,4-Dimethoxythiophene [ACD/IUPAC Name]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 425.5±51.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.0±3.0 kJ/mol
    Flash Point: 211.1±30.4 °C
    Index of Refraction: 1.582
    Molar Refractivity: 65.5±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.32
    ACD/LogD (pH 5.5): 2.52
    ACD/BCF (pH 5.5): 48.51
    ACD/KOC (pH 5.5): 560.22
    ACD/LogD (pH 7.4): 2.52
    ACD/BCF (pH 7.4): 48.51
    ACD/KOC (pH 7.4): 560.22
    Polar Surface Area: 61 Å2
    Polarizability: 26.0±0.5 10-24cm3
    Surface Tension: 52.1±3.0 dyne/cm
    Molar Volume: 196.3±3.0 cm3

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