Found 377 results

Search term: MF = 'C_{19}H_{20}BrNO_{4}S'
ChemSpider 2D Image | 4-(2-Bromobenzyl)-1-(phenylsulfonyl)-4-piperidinecarboxylic acid | C19H20BrNO4S

4-(2-Bromobenzyl)-1-(phenylsulfonyl)-4-piperidinecarboxylic acid

  • Molecular FormulaC19H20BrNO4S
  • Average mass438.335 Da
  • Monoisotopic mass437.029633 Da
  • ChemSpider ID25083802

More details:

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

4-(2-Brombenzyl)-1-(phenylsulfonyl)-4-piperidincarbonsäure [German] [ACD/IUPAC Name]
4-(2-Bromobenzyl)-1-(phenylsulfonyl)-4-piperidinecarboxylic acid [ACD/IUPAC Name]
4-Piperidinecarboxylic acid, 4-[(2-bromophenyl)methyl]-1-(phenylsulfonyl)- [ACD/Index Name]
Acide 4-(2-bromobenzyl)-1-(phénylsulfonyl)-4-pipéridinecarboxylique [French] [ACD/IUPAC Name]
1-(benzenesulfonyl)-4-[(2-bromophenyl)methyl]piperidine-4-carboxylic acid
1171661-56-5 [RN]
4-(2-bromobenzyl)-1-(phenylsulfonyl)piperidine-4-carboxylic acid
AKOS015957338
F2189-0058
MCULE-4789883242
More...

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 592.2±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 92.9±3.0 kJ/mol
    Flash Point: 311.9±32.9 °C
    Index of Refraction: 1.636
    Molar Refractivity: 103.9±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 4.49
    ACD/LogD (pH 5.5): 2.93
    ACD/BCF (pH 5.5): 48.31
    ACD/KOC (pH 5.5): 236.97
    ACD/LogD (pH 7.4): 1.16
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.98
    Polar Surface Area: 83 Å2
    Polarizability: 41.2±0.5 10-24cm3
    Surface Tension: 59.1±3.0 dyne/cm
    Molar Volume: 289.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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