ChemSpider 2D Image | 3-({[(tert-butoxy)carbonyl]amino}methyl)-1,2,4-oxadiazole-5-carboxylic acid | C9H13N3O5

3-({[(tert-butoxy)carbonyl]amino}methyl)-1,2,4-oxadiazole-5-carboxylic acid

  • Molecular FormulaC9H13N3O5
  • Average mass243.217 Da
  • Monoisotopic mass243.085526 Da
  • ChemSpider ID26519206

More details:

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

1,2,4-Oxadiazole-5-carboxylic acid, 3-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]- [ACD/Index Name]
3-({[(tert-butoxy)carbonyl]amino}methyl)-1,2,4-oxadiazole-5-carboxylic acid
3-[({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)methyl]-1,2,4-oxadiazol-5-carbonsäure [German] [ACD/IUPAC Name]
3-[({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)methyl]-1,2,4-oxadiazole-5-carboxylic acid [ACD/IUPAC Name]
946667-81-8 [RN]
Acide 3-[({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)méthyl]-1,2,4-oxadiazole-5-carboxylique [French] [ACD/IUPAC Name]
3-(((tert-Butoxycarbonyl)amino)methyl)-1,2,4-oxadiazole-5-carboxylic acid
3-((TERT-BUTOXYCARBONYLAMINO)METHYL)-1,2,4-OXADIAZOLE-5-CARBOXYLIC ACID
3-(tert-Butoxycarbonylamino-methyl)-[1,2,4]oxadiazole-5-carboxylic acid
3-[(tert-butoxycarbonylamino)methyl]-1,2,4-oxadiazole-5-carboxylic acid
More...

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

    Density: 1.3±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.516
    Molar Refractivity: 55.1±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 0.30
    ACD/LogD (pH 5.5): -2.40
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.49
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 115 Å2
    Polarizability: 21.8±0.5 10-24cm3
    Surface Tension: 54.3±3.0 dyne/cm
    Molar Volume: 182.4±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement