ChemSpider 2D Image | 2-[{4-[2-(Cyclopropylmethoxy)ethyl]phenoxy}(~2~H_2_)methyl](~2~H_3_)oxirane | C15H15D5O3

2-[{4-[2-(Cyclopropylmethoxy)ethyl]phenoxy}(2H2)methyl](2H3)oxirane

  • Molecular FormulaC15H15D5O3
  • Average mass253.348 Da
  • Monoisotopic mass253.172623 Da
  • ChemSpider ID28578693
  • Non-standard isotope - Non-standard isotope


More details:






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

2-[{4-[2-(Cyclopropylmethoxy)ethyl]phenoxy}(2H2)methyl](2H3)oxiran [German] [ACD/IUPAC Name]
2-[{4-[2-(Cyclopropylmethoxy)ethyl]phenoxy}(2H2)methyl](2H3)oxirane [ACD/IUPAC Name]
2-[{4-[2-(Cyclopropylméthoxy)éthyl]phénoxy}(2H2)méthyl](2H3)oxirane [French] [ACD/IUPAC Name]
Oxirane-2,2,3-d3, 3-[[4-[2-(cyclopropylmethoxy)ethyl]phenoxy]methyl-d2]- [ACD/Index Name]
[[4-[2-(CYCLOPROPYLMETHOXY)ETHYL]PHENOXY]METHYL]OXIRANE-D5
1185169-90-7 [RN]
2-[[4-[2-(cyclopropylmethoxy)ethyl]phenoxy]-dideuteriomethyl]-2,3,3-trideuteriooxirane
63659-17-6 [RN]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 358.3±17.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 58.0±3.0 kJ/mol
    Flash Point: 120.8±18.2 °C
    Index of Refraction: 1.549
    Molar Refractivity: 69.5±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 2.56
    ACD/LogD (pH 5.5): 2.37
    ACD/BCF (pH 5.5): 37.45
    ACD/KOC (pH 5.5): 465.50
    ACD/LogD (pH 7.4): 2.37
    ACD/BCF (pH 7.4): 37.45
    ACD/KOC (pH 7.4): 465.50
    Polar Surface Area: 31 Å2
    Polarizability: 27.6±0.5 10-24cm3
    Surface Tension: 46.0±3.0 dyne/cm
    Molar Volume: 218.7±3.0 cm3

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