ChemSpider 2D Image | Bis(3-phenylpropyl) 5,5'-(1,2-propanediyldiimino)bis(5-oxopentanoate) | C31H42N2O6

Bis(3-phenylpropyl) 5,5'-(1,2-propanediyldiimino)bis(5-oxopentanoate)

  • Molecular FormulaC31H42N2O6
  • Average mass538.675 Da
  • Monoisotopic mass538.304260 Da
  • ChemSpider ID4105923

More details:

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

5,5'-(1,2-Propanediyldiimino)bis(5-oxopentanoate) de bis(3-phénylpropyle) [French] [ACD/IUPAC Name]
Bis(3-phenylpropyl) 5,5'-(1,2-propanediyldiimino)bis(5-oxopentanoate) [ACD/IUPAC Name]
Bis(3-phenylpropyl)-5,5'-(1,2-propandiyldiimino)bis(5-oxopentanoat) [German] [ACD/IUPAC Name]
Pentanoic acid, 5,5'-[(1-methyl-1,2-ethanediyl)diimino]bis[5-oxo-, bis(3-phenylpropyl) ester [ACD/Index Name]
3-PHENYLPROPYL 4-({1-[5-OXO-5-(3-PHENYLPROPOXY)PENTANAMIDO]PROPAN-2-YL}CARBAMOYL)BUTANOATE
3-phenylpropyl 4-[N-(2-{4-[(3-phenylpropyl)oxycarbonyl]butanoylamino}propyl)carbamoyl]butanoate
3-phenylpropyl 5-[(1-methyl-2-{[5-oxo-5-(3-phenylpropoxy)pentanoyl]amino}ethyl)amino]-5-oxopentanoate
3-phenylpropyl 5-oxo-5-[2-[[5-oxo-5-(3-phenylpropoxy)pentanoyl]amino]propylamino]pentanoate
4-{2-[4-(3-Phenyl-propoxycarbonyl)-butyrylamino]-propylcarbamoyl}-butyric acid 3-phenyl-propyl ester
875883-00-4 [RN]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 744.3±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.5 mmHg at 25°C
    Enthalpy of Vaporization: 108.5±3.0 kJ/mol
    Flash Point: 403.9±32.9 °C
    Index of Refraction: 1.533
    Molar Refractivity: 149.8±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 21
    #Rule of 5 Violations: 1
    ACD/LogP: 4.70
    ACD/LogD (pH 5.5): 4.58
    ACD/BCF (pH 5.5): 1781.83
    ACD/KOC (pH 5.5): 7388.68
    ACD/LogD (pH 7.4): 4.58
    ACD/BCF (pH 7.4): 1781.83
    ACD/KOC (pH 7.4): 7388.69
    Polar Surface Area: 111 Å2
    Polarizability: 59.4±0.5 10-24cm3
    Surface Tension: 44.3±3.0 dyne/cm
    Molar Volume: 482.8±3.0 cm3

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