ChemSpider 2D Image | 2-Methyl-2-propanyl 2-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]-1-pyrrolidinecarboxylate | C13H22N4O3

2-Methyl-2-propanyl 2-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]-1-pyrrolidinecarboxylate

  • Molecular FormulaC13H22N4O3
  • Average mass282.339 Da
  • Monoisotopic mass282.169189 Da
  • ChemSpider ID34212596

More details:

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

1-Pyrrolidinecarboxylic acid, 2-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-[3-(Diméthylamino)-1,2,4-oxadiazol-5-yl]-1-pyrrolidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 2-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-2-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]-1-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
1803610-60-7 [RN]
MFCD27980641
tert-butyl 2-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]pyrrolidine-1-carboxylate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 388.5±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.8±3.0 kJ/mol
Flash Point: 188.7±30.7 °C
Index of Refraction: 1.534
Molar Refractivity: 74.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.40
ACD/LogD (pH 5.5): 1.66
ACD/BCF (pH 5.5): 10.71
ACD/KOC (pH 5.5): 190.01
ACD/LogD (pH 7.4): 1.66
ACD/BCF (pH 7.4): 10.71
ACD/KOC (pH 7.4): 190.04
Polar Surface Area: 72 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 49.4±3.0 dyne/cm
Molar Volume: 238.4±3.0 cm3

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