ChemSpider 2D Image | 2-(2-Chlorobenzyl)-4-[(4-phenyl-1-piperidinyl)carbonyl]-1(2H)-phthalazinone | C27H24ClN3O2

2-(2-Chlorobenzyl)-4-[(4-phenyl-1-piperidinyl)carbonyl]-1(2H)-phthalazinone

  • Molecular FormulaC27H24ClN3O2
  • Average mass457.951 Da
  • Monoisotopic mass457.155701 Da
  • ChemSpider ID21664469

More details:

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

1(2H)-Phthalazinone, 2-[(2-chlorophenyl)methyl]-4-[(4-phenyl-1-piperidinyl)carbonyl]- [ACD/Index Name]
2-(2-Chlorbenzyl)-4-[(4-phenyl-1-piperidinyl)carbonyl]-1(2H)-phthalazinon [German] [ACD/IUPAC Name]
2-(2-Chlorobenzyl)-4-[(4-phényl-1-pipéridinyl)carbonyl]-1(2H)-phtalazinone [French] [ACD/IUPAC Name]
2-(2-Chlorobenzyl)-4-[(4-phenyl-1-piperidinyl)carbonyl]-1(2H)-phthalazinone [ACD/IUPAC Name]
2-(2-chlorobenzyl)-4-[(4-phenylpiperidin-1-yl)carbonyl]phthalazin-1(2H)-one
2-[(2-chlorophenyl)methyl]-4-(4-phenylpiperidine-1-carbonyl)-1,2-dihydrophthalazin-1-one
2-[(2-chlorophenyl)methyl]-4-(4-phenylpiperidine-1-carbonyl)phthalazin-1-one
2-[(2-chlorophenyl)methyl]-4-[(4-phenylpiperidyl)carbonyl]-2-hydrophthalazin-1-one
924829-41-4 [RN]
MFCD09063072
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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: 631.7±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 93.4±3.0 kJ/mol
    Flash Point: 335.9±34.3 °C
    Index of Refraction: 1.664
    Molar Refractivity: 131.5±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.56
    ACD/LogD (pH 5.5): 4.80
    ACD/BCF (pH 5.5): 2629.54
    ACD/KOC (pH 5.5): 9762.16
    ACD/LogD (pH 7.4): 4.80
    ACD/BCF (pH 7.4): 2629.54
    ACD/KOC (pH 7.4): 9762.16
    Polar Surface Area: 53 Å2
    Polarizability: 52.1±0.5 10-24cm3
    Surface Tension: 51.8±7.0 dyne/cm
    Molar Volume: 354.4±7.0 cm3

    Click to predict properties on the Chemicalize site


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