ChemSpider 2D Image | Ethyl (2S)-2,5-di[(2S)-2-butanyl]-6-oxo-3,6-dihydro-2H-1,3,4-oxadiazine-2-carboxylate | C14H24N2O4

Ethyl (2S)-2,5-di[(2S)-2-butanyl]-6-oxo-3,6-dihydro-2H-1,3,4-oxadiazine-2-carboxylate

  • Molecular FormulaC14H24N2O4
  • Average mass284.351 Da
  • Monoisotopic mass284.173615 Da
  • ChemSpider ID78439508

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2S)-2,5-Di[(2S)-2-butanyl]-6-oxo-3,6-dihydro-2H-1,3,4-oxadiazine-2-carboxylate d'éthyle [French] [ACD/IUPAC Name]
2H-1,3,4-Oxadiazine-2-carboxylic acid, 3,6-dihydro-2,5-bis[(1S)-1-methylpropyl]-6-oxo-, ethyl ester, (2S)- [ACD/Index Name]
Ethyl (2S)-2,5-di[(2S)-2-butanyl]-6-oxo-3,6-dihydro-2H-1,3,4-oxadiazine-2-carboxylate [ACD/IUPAC Name]
Ethyl-(2S)-2,5-di[(2S)-2-butanyl]-6-oxo-3,6-dihydro-2H-1,3,4-oxadiazin-2-carboxylat [German] [ACD/IUPAC Name]
Conflamide G

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

Density: 1.1±0.1 g/cm3
Boiling Point: 339.7±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.3±3.0 kJ/mol
Flash Point: 159.2±30.7 °C
Index of Refraction: 1.516
Molar Refractivity: 74.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.14
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 77 Å2
Polarizability: 29.6±0.5 10-24cm3
Surface Tension: 36.1±7.0 dyne/cm
Molar Volume: 247.5±7.0 cm3

Click to predict properties on the Chemicalize site


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