ChemSpider 2D Image | salinazinone A | C13H16N2O4

salinazinone A

  • Molecular FormulaC13H16N2O4
  • Average mass264.277 Da
  • Monoisotopic mass264.110992 Da
  • ChemSpider ID40256755

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

4-[(2S,3S)-3-Hydroxy-2-methyl-5-oxo-1-pyrrolidinyl]-2-(2-methyl-1-propen-1-yl)-6H-1,3-oxazin-6-on [German] [ACD/IUPAC Name]
4-[(2S,3S)-3-Hydroxy-2-methyl-5-oxo-1-pyrrolidinyl]-2-(2-methyl-1-propen-1-yl)-6H-1,3-oxazin-6-one [ACD/IUPAC Name]
4-[(2S,3S)-3-Hydroxy-2-méthyl-5-oxo-1-pyrrolidinyl]-2-(2-méthyl-1-propén-1-yl)-6H-1,3-oxazin-6-one [French] [ACD/IUPAC Name]
6H-1,3-Oxazin-6-one, 4-[(2S,3S)-3-hydroxy-2-methyl-5-oxo-1-pyrrolidinyl]-2-(2-methyl-1-propen-1-yl)- [ACD/Index Name]
c5np90052B - salinazinone A
salinazinone A
Spinoxazine A

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

Density: 1.3±0.1 g/cm3
Boiling Point: 438.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 80.3±6.0 kJ/mol
Flash Point: 219.1±31.5 °C
Index of Refraction: 1.607
Molar Refractivity: 67.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.67
ACD/LogD (pH 5.5): 0.77
ACD/BCF (pH 5.5): 2.26
ACD/KOC (pH 5.5): 62.44
ACD/LogD (pH 7.4): 0.77
ACD/BCF (pH 7.4): 2.26
ACD/KOC (pH 7.4): 62.44
Polar Surface Area: 79 Å2
Polarizability: 26.9±0.5 10-24cm3
Surface Tension: 47.2±7.0 dyne/cm
Molar Volume: 196.1±7.0 cm3

Click to predict properties on the Chemicalize site


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