ChemSpider 2D Image | 1-[5-(Ethoxymethyl)-1,3,4-thiadiazol-2-yl]-5-oxo-3-pyrrolidinecarboxylic acid | C10H13N3O4S

1-[5-(Ethoxymethyl)-1,3,4-thiadiazol-2-yl]-5-oxo-3-pyrrolidinecarboxylic acid

  • Molecular FormulaC10H13N3O4S
  • Average mass271.293 Da
  • Monoisotopic mass271.062683 Da
  • ChemSpider ID59703245

More details:

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

1-[5-(Ethoxymethyl)-1,3,4-thiadiazol-2-yl]-5-oxo-3-pyrrolidincarbonsäure [German] [ACD/IUPAC Name]
1-[5-(Ethoxymethyl)-1,3,4-thiadiazol-2-yl]-5-oxo-3-pyrrolidinecarboxylic acid [ACD/IUPAC Name]
3-Pyrrolidinecarboxylic acid, 1-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-5-oxo- [ACD/Index Name]
Acide 1-[5-(éthoxyméthyl)-1,3,4-thiadiazol-2-yl]-5-oxo-3-pyrrolidinecarboxylique [French] [ACD/IUPAC Name]
1-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-5-oxopyrrolidine-3-carboxylic acid
2173108-95-5 [RN]
MFCD30723520

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 475.0±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 77.8±3.0 kJ/mol
    Flash Point: 241.0±31.5 °C
    Index of Refraction: 1.602
    Molar Refractivity: 63.2±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: -1.03
    ACD/LogD (pH 5.5): -2.13
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.72
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 121 Å2
    Polarizability: 25.0±0.5 10-24cm3
    Surface Tension: 74.1±3.0 dyne/cm
    Molar Volume: 184.3±3.0 cm3

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