ChemSpider 2D Image | Ethyl {2-imino-3-[4-(isopropylamino)-6-methoxy-1,3,5-triazin-2-yl]-5-oxo-1-imidazolidinyl}acetate | C14H21N7O4

Ethyl {2-imino-3-[4-(isopropylamino)-6-methoxy-1,3,5-triazin-2-yl]-5-oxo-1-imidazolidinyl}acetate

  • Molecular FormulaC14H21N7O4
  • Average mass351.361 Da
  • Monoisotopic mass351.165497 Da
  • ChemSpider ID21525876

More details:

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

{2-Imino-3-[4-(isopropylamino)-6-méthoxy-1,3,5-triazin-2-yl]-5-oxo-1-imidazolidinyl}acétate d'éthyle [French] [ACD/IUPAC Name]
1-Imidazolidineacetic acid, 2-imino-3-[4-methoxy-6-[(1-methylethyl)amino]-1,3,5-triazin-2-yl]-5-oxo-, ethyl ester [ACD/Index Name]
Ethyl {2-imino-3-[4-(isopropylamino)-6-methoxy-1,3,5-triazin-2-yl]-5-oxo-1-imidazolidinyl}acetate [ACD/IUPAC Name]
Ethyl-{2-imino-3-[4-(isopropylamino)-6-methoxy-1,3,5-triazin-2-yl]-5-oxo-1-imidazolidinyl}acetat [German] [ACD/IUPAC Name]
383161-73-7 [RN]
ethyl {2-imino-3-[4-methoxy-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]-5-oxoimidazolidin-1-yl}acetate
ethyl 2-(2-imino-3-(4-(isopropylimino)-6-methoxy-1,4-dihydro-1,3,5-triazin-2-yl)-5-oxoimidazolidin-1-yl)acetate

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 494.5±47.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 76.2±3.0 kJ/mol
    Flash Point: 252.8±29.3 °C
    Index of Refraction: 1.644
    Molar Refractivity: 87.8±0.5 cm3
    #H bond acceptors: 11
    #H bond donors: 2
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 1
    ACD/LogP: -0.83
    ACD/LogD (pH 5.5): -0.27
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 16.93
    ACD/LogD (pH 7.4): -0.27
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 16.96
    Polar Surface Area: 134 Å2
    Polarizability: 34.8±0.5 10-24cm3
    Surface Tension: 54.9±7.0 dyne/cm
    Molar Volume: 242.2±7.0 cm3

    Click to predict properties on the Chemicalize site


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