ChemSpider 2D Image | Methyl 3-chloro-4-(1-piperazinyl)benzoate | C12H15ClN2O2

Methyl 3-chloro-4-(1-piperazinyl)benzoate

  • Molecular FormulaC12H15ClN2O2
  • Average mass254.713 Da
  • Monoisotopic mass254.082199 Da
  • ChemSpider ID13411224

More details:

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

234082-16-7 [RN]
3-Chloro-4-(1-pipérazinyl)benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-chloro-4-(1-piperazinyl)-, methyl ester [ACD/Index Name]
Methyl 3-chloro-4-(1-piperazinyl)benzoate [ACD/IUPAC Name]
Methyl 3-chloro-4-(piperazin-1-yl)benzoate
Methyl-3-chlor-4-(1-piperazinyl)benzoat [German] [ACD/IUPAC Name]
[234082-16-7] [RN]
1074-82-4 [RN]
1-Ethynyl-3-nitrobenzene [ACD/IUPAC Name]
3-Nitrophenylacetylene
More...

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 407.3±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 65.9±3.0 kJ/mol
    Flash Point: 200.2±28.7 °C
    Index of Refraction: 1.553
    Molar Refractivity: 66.5±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.10
    ACD/LogD (pH 5.5): -0.55
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 1.10
    ACD/BCF (pH 7.4): 2.22
    ACD/KOC (pH 7.4): 30.65
    Polar Surface Area: 42 Å2
    Polarizability: 26.4±0.5 10-24cm3
    Surface Tension: 42.5±3.0 dyne/cm
    Molar Volume: 207.6±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement