ChemSpider 2D Image | Ethyl 4-[bis(2-hydroxypropyl)amino](~2~H_4_)benzoate | C15H19D4NO4

Ethyl 4-[bis(2-hydroxypropyl)amino](2H4)benzoate

  • Molecular FormulaC15H19D4NO4
  • Average mass285.372 Da
  • Monoisotopic mass285.187805 Da
  • ChemSpider ID48058959

  • Non-standard isotope - Non-standard isotope

More details:

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

4-[Bis(2-hydroxypropyl)amino](2H4)benzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic-2,3,5,6-d4 acid, 4-[bis(2-hydroxypropyl)amino]-, ethyl ester [ACD/Index Name]
Ethyl 4-[bis(2-hydroxypropyl)amino](2H4)benzoate [ACD/IUPAC Name]
Ethyl-4-[bis(2-hydroxypropyl)amino](2H4)benzoat [German] [ACD/IUPAC Name]
1189469-25-7 [RN]
4-[BIS(2-HYDROXYPROPYL)AMINO]BENZOIC ACID-D4 ETHYL ESTER
ethyl 4-[bis(2-hydroxypropyl)amino]-2,3,5,6-tetradeuteriobenzoate
MFCD28898802

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 450.0±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 74.7±3.0 kJ/mol
    Flash Point: 225.9±27.3 °C
    Index of Refraction: 1.558
    Molar Refractivity: 78.5±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 2.32
    ACD/LogD (pH 5.5): 1.80
    ACD/BCF (pH 5.5): 13.67
    ACD/KOC (pH 5.5): 226.24
    ACD/LogD (pH 7.4): 1.80
    ACD/BCF (pH 7.4): 13.67
    ACD/KOC (pH 7.4): 226.28
    Polar Surface Area: 70 Å2
    Polarizability: 31.1±0.5 10-24cm3
    Surface Tension: 48.0±3.0 dyne/cm
    Molar Volume: 243.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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