ChemSpider 2D Image | 2-(1,3,5-Trimethyl-1H-pyrazol-4-yl)acetamide | C8H13N3O

2-(1,3,5-Trimethyl-1H-pyrazol-4-yl)acetamide

  • Molecular FormulaC8H13N3O
  • Average mass167.208 Da
  • Monoisotopic mass167.105865 Da
  • ChemSpider ID21588325

More details:

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

1017502-16-7 [RN]
1H-Pyrazole-4-acetamide, 1,3,5-trimethyl- [ACD/Index Name]
2-(1,3,5-Trimethyl-1H-pyrazol-4-yl)acetamid [German] [ACD/IUPAC Name]
2-(1,3,5-Trimethyl-1H-pyrazol-4-yl)acetamide [ACD/IUPAC Name]
2-(1,3,5-Triméthyl-1H-pyrazol-4-yl)acétamide [French] [ACD/IUPAC Name]
MFCD08685646 [MDL number]
[1017502-16-7] [RN]
2-(1,3,5-Trimethyl-1H-pyrazol-4-yl)-acetamide
2-(1,3,5-trimethylpyrazol-4-yl)acetamide
2-(trimethyl-1H-pyrazol-4-yl)acetamide

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 368.9±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.6±3.0 kJ/mol
    Flash Point: 176.9±24.6 °C
    Index of Refraction: 1.574
    Molar Refractivity: 46.1±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.68
    ACD/LogD (pH 5.5): 0.26
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 32.81
    ACD/LogD (pH 7.4): 0.26
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 32.94
    Polar Surface Area: 61 Å2
    Polarizability: 18.3±0.5 10-24cm3
    Surface Tension: 40.6±7.0 dyne/cm
    Molar Volume: 139.7±7.0 cm3

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