ChemSpider 2D Image | Bis(2-methyl-2-propanyl) 4,4'-[(Z)-1,2-ethenediyldi-2,1-phenylene]di(1-piperazinecarboxylate) | C32H44N4O4

Bis(2-methyl-2-propanyl) 4,4'-[(Z)-1,2-ethenediyldi-2,1-phenylene]di(1-piperazinecarboxylate)

  • Molecular FormulaC32H44N4O4
  • Average mass548.716 Da
  • Monoisotopic mass548.336243 Da
  • ChemSpider ID29739242

  • Double-bond stereo - Double-bond stereo

More details:

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

1-Piperazinecarboxylic acid, 4,4'-[(Z)-1,2-ethenediyldi-2,1-phenylene]bis-, bis(1,1-dimethylethyl) ester [ACD/Index Name]
4,4'-[(Z)-1,2-Éthènediyldi-2,1-phénylène]di(1-pipérazinecarboxylate) de bis(2-méthyl-2-propanyle) [French] [ACD/IUPAC Name]
Bis(2-methyl-2-propanyl) 4,4'-[(Z)-1,2-ethenediyldi-2,1-phenylene]di(1-piperazinecarboxylate) [ACD/IUPAC Name]
Bis(2-methyl-2-propanyl)-4,4'-[(Z)-1,2-ethendiyldi-2,1-phenylen]di(1-piperazincarboxylat) [German] [ACD/IUPAC Name]
1315619-65-8 [RN]
GF-0075
MFCD19686139 [MDL number]
tert-butyl 4-{2-[(Z)-2-(2-{4-[(tert-butoxy)carbonyl]piperazin-1-yl}phenyl)ethenyl]phenyl}piperazine-1-carboxylate

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 665.0±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.0 mmHg at 25°C
    Enthalpy of Vaporization: 97.8±3.0 kJ/mol
    Flash Point: 356.0±31.5 °C
    Index of Refraction: 1.594
    Molar Refractivity: 160.8±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 0
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 1
    ACD/LogP: 4.91
    ACD/LogD (pH 5.5): 5.30
    ACD/BCF (pH 5.5): 6273.54
    ACD/KOC (pH 5.5): 18168.67
    ACD/LogD (pH 7.4): 5.30
    ACD/BCF (pH 7.4): 6300.11
    ACD/KOC (pH 7.4): 18245.61
    Polar Surface Area: 66 Å2
    Polarizability: 63.8±0.5 10-24cm3
    Surface Tension: 48.9±3.0 dyne/cm
    Molar Volume: 473.7±3.0 cm3

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