ChemSpider 2D Image | Dimethyl 3,3'-[(2-nitro-1,4-phenylene)bis(oxy)]dipropanoate | C14H17NO8

Dimethyl 3,3'-[(2-nitro-1,4-phenylene)bis(oxy)]dipropanoate

  • Molecular FormulaC14H17NO8
  • Average mass327.287 Da
  • Monoisotopic mass327.095428 Da
  • ChemSpider ID21665876

More details:

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

3,3'-[(2-Nitro-1,4-phénylène)bis(oxy)]dipropanoate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 3,3'-[(2-nitro-1,4-phenylene)bis(oxy)]dipropanoate [ACD/IUPAC Name]
Dimethyl-3,3'-[(2-nitro-1,4-phenylen)bis(oxy)]dipropanoat [German] [ACD/IUPAC Name]
Propanoic acid, 3,3'-[(2-nitro-1,4-phenylene)bis(oxy)]bis-, dimethyl ester [ACD/Index Name]
3-[4-(2-Methoxycarbonyl-ethoxy)-3-nitro-phenoxy]-propionic acid methyl ester
924831-90-3 [RN]
AGN-PC-015N6K
AKOS005536398
dimethyl 3,3'-[(2-nitrobenzene-1,4-diyl)bis(oxy)]dipropanoate
MCULE-4051487361
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 463.5±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 72.5±3.0 kJ/mol
    Flash Point: 192.1±30.7 °C
    Index of Refraction: 1.519
    Molar Refractivity: 77.5±0.3 cm3
    #H bond acceptors: 9
    #H bond donors: 0
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 0
    ACD/LogP: 1.92
    ACD/LogD (pH 5.5): 1.92
    ACD/BCF (pH 5.5): 17.00
    ACD/KOC (pH 5.5): 264.48
    ACD/LogD (pH 7.4): 1.92
    ACD/BCF (pH 7.4): 17.00
    ACD/KOC (pH 7.4): 264.48
    Polar Surface Area: 117 Å2
    Polarizability: 30.7±0.5 10-24cm3
    Surface Tension: 45.8±3.0 dyne/cm
    Molar Volume: 255.3±3.0 cm3

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