ChemSpider 2D Image | ethyl 3-(morpholine-4-sulfonyl)-1H-pyrazole-4-carboxylate | C10H15N3O5S

ethyl 3-(morpholine-4-sulfonyl)-1H-pyrazole-4-carboxylate

  • Molecular FormulaC10H15N3O5S
  • Average mass289.308 Da
  • Monoisotopic mass289.073242 Da
  • ChemSpider ID22279188

More details:

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

1108050-18-5 [RN]
1H-Pyrazole-4-carboxylic acid, 5-(4-morpholinylsulfonyl)-, ethyl ester [ACD/Index Name]
5-(4-Morpholinylsulfonyl)-1H-pyrazole-4-carboxylate d'éthyle [French] [ACD/IUPAC Name]
ethyl 3-(morpholine-4-sulfonyl)-1H-pyrazole-4-carboxylate
Ethyl 5-(4-morpholinylsulfonyl)-1H-pyrazole-4-carboxylate [ACD/IUPAC Name]
Ethyl-5-(4-morpholinylsulfonyl)-1H-pyrazol-4-carboxylat [German] [ACD/IUPAC Name]
[1108050-18-5] [RN]
3-(Morpholine-4-sulfonyl)-1H-pyrazole-4-carboxylic acid ethyl ester
AGN-PC-059IUG
AKOS004961214
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 534.5±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 81.1±3.0 kJ/mol
    Flash Point: 277.1±32.9 °C
    Index of Refraction: 1.559
    Molar Refractivity: 65.1±0.4 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: -0.11
    ACD/LogD (pH 5.5): 0.48
    ACD/BCF (pH 5.5): 1.37
    ACD/KOC (pH 5.5): 43.52
    ACD/LogD (pH 7.4): 0.45
    ACD/BCF (pH 7.4): 1.28
    ACD/KOC (pH 7.4): 40.81
    Polar Surface Area: 110 Å2
    Polarizability: 25.8±0.5 10-24cm3
    Surface Tension: 60.0±3.0 dyne/cm
    Molar Volume: 201.8±3.0 cm3

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