ChemSpider 2D Image | {3-[4-(3-Chlorophenyl)-1-piperazinyl]-6-oxo-1(6H)-pyridazinyl}acetic acid | C16H17ClN4O3

{3-[4-(3-Chlorophenyl)-1-piperazinyl]-6-oxo-1(6H)-pyridazinyl}acetic acid

  • Molecular FormulaC16H17ClN4O3
  • Average mass348.784 Da
  • Monoisotopic mass348.098907 Da
  • ChemSpider ID32083812

More details:

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

{3-[4-(3-Chlorophenyl)-1-piperazinyl]-6-oxo-1(6H)-pyridazinyl}acetic acid [ACD/IUPAC Name]
{3-[4-(3-Chlorphenyl)-1-piperazinyl]-6-oxo-1(6H)-pyridazinyl}essigsäure [German] [ACD/IUPAC Name]
1(6H)-Pyridazineacetic acid, 3-[4-(3-chlorophenyl)-1-piperazinyl]-6-oxo- [ACD/Index Name]
Acide {3-[4-(3-chlorophényl)-1-pipérazinyl]-6-oxo-1(6H)-pyridazinyl}acétique [French] [ACD/IUPAC Name]
[3-[4-(3-chlorophenyl)piperazin-1-yl]-6-oxopyridazin-1(6H)-yl]acetic acid
{3-[4-(3-CHLOROPHENYL)PIPERAZIN-1-YL]-6-OXOPYRIDAZIN-1-YL}ACETIC ACID
1352506-14-9 [RN]
2-[3-[4-(3-chlorophenyl)piperazin-1-yl]-6-oxopyridazin-1-yl]acetic acid
2-[3-[4-(3-chlorophenyl)piperazin-1-yl]-6-oxo-pyridazin-1-yl]acetic acid
2-{3-[4-(3-chlorophenyl)piperazin-1-yl]-6-oxo-1,6-dihydropyridazin-1-yl}acetic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 570.0±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 89.9±3.0 kJ/mol
    Flash Point: 298.5±32.9 °C
    Index of Refraction: 1.670
    Molar Refractivity: 90.7±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 0.34
    ACD/LogD (pH 5.5): -0.91
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.28
    ACD/LogD (pH 7.4): -2.57
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 76 Å2
    Polarizability: 36.0±0.5 10-24cm3
    Surface Tension: 59.9±7.0 dyne/cm
    Molar Volume: 242.9±7.0 cm3

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