ChemSpider 2D Image | 4-(3-Bromophenyl)-2-pyrrolidinone | C10H10BrNO

4-(3-Bromophenyl)-2-pyrrolidinone

  • Molecular FormulaC10H10BrNO
  • Average mass240.096 Da
  • Monoisotopic mass238.994568 Da
  • ChemSpider ID23499631

More details:

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

1105187-44-7 [RN]
2-Pyrrolidinone, 4-(3-bromophenyl)- [ACD/Index Name]
4-(3-Bromophenyl)-2-pyrrolidinone [ACD/IUPAC Name]
4-(3-Bromophényl)-2-pyrrolidinone [French] [ACD/IUPAC Name]
4-(3-Bromophenyl)pyrrolidin-2-one
4-(3-Bromphenyl)-2-pyrrolidinon [German] [ACD/IUPAC Name]
(R)-4-(3-BROMOPHENYL)PYRROLIDIN-2-ONE
(S)-4-(3-BROMOPHENYL)PYRROLIDIN-2-ONE
[1105187-44-7] [RN]
1384268-55-6 [RN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 405.7±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 65.7±3.0 kJ/mol
    Flash Point: 199.2±28.7 °C
    Index of Refraction: 1.584
    Molar Refractivity: 54.1±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 0.97
    ACD/LogD (pH 5.5): 1.92
    ACD/BCF (pH 5.5): 17.04
    ACD/KOC (pH 5.5): 264.92
    ACD/LogD (pH 7.4): 1.92
    ACD/BCF (pH 7.4): 17.04
    ACD/KOC (pH 7.4): 264.92
    Polar Surface Area: 29 Å2
    Polarizability: 21.4±0.5 10-24cm3
    Surface Tension: 44.3±3.0 dyne/cm
    Molar Volume: 161.6±3.0 cm3

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