ChemSpider 2D Image | Methyl 4-cyclohexyl-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylate | C10H15N3O3

Methyl 4-cyclohexyl-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylate

  • Molecular FormulaC10H15N3O3
  • Average mass225.244 Da
  • Monoisotopic mass225.111343 Da
  • ChemSpider ID24756262

More details:

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

1212059-41-0 [RN]
1H-1,2,4-Triazole-3-carboxylic acid, 4-cyclohexyl-4,5-dihydro-5-oxo-, methyl ester [ACD/Index Name]
4-Cyclohexyl-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 4-cyclohexyl-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylate [ACD/IUPAC Name]
Methyl-4-cyclohexyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-carboxylat [German] [ACD/IUPAC Name]
4-Cyclohexyl-5-oxo-4,5-dihydro-1H-[1,2,4]triazole-3-carboxylic acid methyl ester
methyl 4-cyclohexyl-5-oxo-1,2,4-triazoline-3-carboxylate
methyl 4-cyclohexyl-5-oxo-1H-1,2,4-triazole-3-carboxylate
MFCD13705098 [MDL number]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.639
    Molar Refractivity: 56.5±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.35
    ACD/LogD (pH 5.5): 0.62
    ACD/BCF (pH 5.5): 1.75
    ACD/KOC (pH 5.5): 51.91
    ACD/LogD (pH 7.4): 0.62
    ACD/BCF (pH 7.4): 1.73
    ACD/KOC (pH 7.4): 51.48
    Polar Surface Area: 71 Å2
    Polarizability: 22.4±0.5 10-24cm3
    Surface Tension: 55.0±7.0 dyne/cm
    Molar Volume: 157.0±7.0 cm3

    Click to predict properties on the Chemicalize site


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