ChemSpider 2D Image | ethyl 5-{1-[(tert-butoxy)carbonyl]pyrrolidin-2-yl}-1,2,4-oxadiazole-3-carboxylate | C14H21N3O5

ethyl 5-{1-[(tert-butoxy)carbonyl]pyrrolidin-2-yl}-1,2,4-oxadiazole-3-carboxylate

  • Molecular FormulaC14H21N3O5
  • Average mass311.334 Da
  • Monoisotopic mass311.148132 Da
  • ChemSpider ID34214159

More details:

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

1,2,4-Oxadiazole-3-carboxylic acid, 5-[1-[(1,1-dimethylethoxy)carbonyl]-2-pyrrolidinyl]-, ethyl ester [ACD/Index Name]
1803591-47-0 [RN]
5-(1-{[(2-Méthyl-2-propanyl)oxy]carbonyl}-2-pyrrolidinyl)-1,2,4-oxadiazole-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 5-(1-{[(2-methyl-2-propanyl)oxy]carbonyl}-2-pyrrolidinyl)-1,2,4-oxadiazole-3-carboxylate [ACD/IUPAC Name]
ethyl 5-{1-[(tert-butoxy)carbonyl]pyrrolidin-2-yl}-1,2,4-oxadiazole-3-carboxylate
Ethyl-5-(1-{[(2-methyl-2-propanyl)oxy]carbonyl}-2-pyrrolidinyl)-1,2,4-oxadiazol-3-carboxylat [German] [ACD/IUPAC Name]
MFCD24540964

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

Density: 1.2±0.1 g/cm3
Boiling Point: 422.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.7±3.0 kJ/mol
Flash Point: 209.4±31.5 °C
Index of Refraction: 1.510
Molar Refractivity: 76.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.22
ACD/LogD (pH 5.5): 2.00
ACD/BCF (pH 5.5): 19.37
ACD/KOC (pH 5.5): 290.40
ACD/LogD (pH 7.4): 2.00
ACD/BCF (pH 7.4): 19.37
ACD/KOC (pH 7.4): 290.40
Polar Surface Area: 95 Å2
Polarizability: 30.2±0.5 10-24cm3
Surface Tension: 48.1±3.0 dyne/cm
Molar Volume: 254.8±3.0 cm3

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