ChemSpider 2D Image | OTX008 | C52H72N8O8

OTX008

  • Molecular FormulaC52H72N8O8
  • Average mass937.177 Da
  • Monoisotopic mass936.547302 Da
  • ChemSpider ID10127654

More details:

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

2,2',2'',2'''-[Pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaen-25,26,27,28-tetrayltetrakis(oxy)]tetrakis{N-[2-(dimethylamino)ethyl]acetamid} [German] [ACD/IUPAC Name]
2,2',2'',2'''-[Pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene-25,26,27,28-tetrayltetrakis(oxy)]tetrakis{N-[2-(dimethylamino)ethyl]acetamide 
} [ACD/IUPAC Name]
2,2',2'',2'''-[Pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodécaène-25,26,27,28-tétrayltétrakis(oxy)]tétrakis{N-[2-(diméthylamino)éthyl]acétamide 
} [French] [ACD/IUPAC Name]
2,2',2'',2'''-[pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene-25,26,27,28-tetrayltetrakis(oxy)]tetrakis{N-[2-(dimethylamino)ethyl]acetamide}
286936-40-1 [RN]
8JI63CFH5V
Acetamide, 2,2',2'',2'''-[pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-25,26,27,28-tetrayltetrakis(oxy)]tetrakis[N-[2-(dimethylamino)ethy l]- [ACD/Index Name]
acetamide, 2,2',2'',2'''-[pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-25,26,27,28-tetrayltetrakis(oxy)]tetrakis[N-[2-(dimethylamino)ethyl]-
N-[2-(dimethylamino)ethyl]-2-{[26,27,28-tris({[2-(dimethylamino)ethyl]carbamoyl}methoxy)pentacyclo[19.3.1.1³,?.1?,¹³.1¹?,¹?]octacosa-1(25),3(28),4,6,9(27),10,12,15,17,19(26),21,23-dodecaen-25-yl]oxy}acetamide
OTX008
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

PubChem Substance ID 329825761 [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 1143.4±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 169.2±3.0 kJ/mol
    Flash Point: 645.3±34.3 °C
    Index of Refraction: 1.569
    Molar Refractivity: 265.6±0.3 cm3
    #H bond acceptors: 16
    #H bond donors: 4
    #Freely Rotating Bonds: 24
    #Rule of 5 Violations: 2
    ACD/LogP: 4.14
    ACD/LogD (pH 5.5): -2.09
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.10
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 166 Å2
    Polarizability: 105.3±0.5 10-24cm3
    Surface Tension: 45.9±3.0 dyne/cm
    Molar Volume: 811.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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