ChemSpider 2D Image | (S)-3-Phenylpiperazin-2-one | C10H12N2O

(S)-3-Phenylpiperazin-2-one

  • Molecular FormulaC10H12N2O
  • Average mass176.215 Da
  • Monoisotopic mass176.094955 Da
  • ChemSpider ID32790699

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-Phenyl-2-piperazinon [German] [ACD/IUPAC Name]
(3S)-3-Phenyl-2-piperazinone [ACD/IUPAC Name]
(3S)-3-Phényl-2-pipérazinone [French] [ACD/IUPAC Name]
(S)-3-Phenylpiperazin-2-one
1240585-52-7 [RN]
2-Piperazinone, 3-phenyl-, (3S)- [ACD/Index Name]
(3R)-3-PHENYLPIPERAZIN-2-ONE
(3S)-3-PHENYLPIPERAZIN-2-ONE
1240585-54-9 [RN]
MFCD07373550

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 397.7±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.8±3.0 kJ/mol
    Flash Point: 182.5±28.0 °C
    Index of Refraction: 1.537
    Molar Refractivity: 49.7±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: -0.51
    ACD/LogD (pH 5.5): -0.60
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 4.53
    ACD/LogD (pH 7.4): 0.24
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 30.90
    Polar Surface Area: 41 Å2
    Polarizability: 19.7±0.5 10-24cm3
    Surface Tension: 37.5±3.0 dyne/cm
    Molar Volume: 159.2±3.0 cm3

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