ChemSpider 2D Image | Ethyl 3-[({[(2-methyl-2-propanyl)oxy]carbonyl}amino)methyl]-1,2,4-oxadiazole-5-carboxylate | C11H17N3O5

Ethyl 3-[({[(2-methyl-2-propanyl)oxy]carbonyl}amino)methyl]-1,2,4-oxadiazole-5-carboxylate

  • Molecular FormulaC11H17N3O5
  • Average mass271.270 Da
  • Monoisotopic mass271.116821 Da
  • ChemSpider ID28428672

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]-, ethyl ester [ACD/Index Name]
3-[({[(2-Méthyl-2-propanyl)oxy]carbonyl}amino)méthyl]-1,2,4-oxadiazole-5-carboxylate d'éthyle [French] [ACD/IUPAC Name]
3-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]-1,2,4-oxadiazole-5-carboxylic acid ethyl ester
612511-76-9 [RN]
Ethyl 3-[({[(2-methyl-2-propanyl)oxy]carbonyl}amino)methyl]-1,2,4-oxadiazole-5-carboxylate [ACD/IUPAC Name]
Ethyl-3-[({[(2-methyl-2-propanyl)oxy]carbonyl}amino)methyl]-1,2,4-oxadiazol-5-carboxylat [German] [ACD/IUPAC Name]
1,2,4-OXADIAZOLE-5-CARBOXYLICACID, 3-[[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]METHYL]-, ETHYL ESTER
3-(tert-butoxycarbonylamino-methyl)-[1,2,4]oxadiazole-5-carboxylic acid ethyl ester
ethyl 3-(((tert-butoxycarbonyl)amino)methyl)-1,2,4-oxadiazole-5-carboxylate
ethyl 3-((tert-butoxycarbonylamino)methyl)-1,2,4-oxadiazole-5-carboxylate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.488
Molar Refractivity: 64.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.41
ACD/LogD (pH 5.5): 1.36
ACD/BCF (pH 5.5): 6.41
ACD/KOC (pH 5.5): 131.57
ACD/LogD (pH 7.4): 1.36
ACD/BCF (pH 7.4): 6.39
ACD/KOC (pH 7.4): 131.24
Polar Surface Area: 104 Å2
Polarizability: 25.6±0.5 10-24cm3
Surface Tension: 44.0±3.0 dyne/cm
Molar Volume: 224.3±3.0 cm3

Click to predict properties on the Chemicalize site


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