ChemSpider 2D Image | Methyl {[(3-ethyl-1,2-oxazol-5-yl)methyl]sulfonyl}acetate | C9H13NO5S

Methyl {[(3-ethyl-1,2-oxazol-5-yl)methyl]sulfonyl}acetate

  • Molecular FormulaC9H13NO5S
  • Average mass247.268 Da
  • Monoisotopic mass247.051437 Da
  • ChemSpider ID21805297

More details:

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

{[(3-Éthyl-1,2-oxazol-5-yl)méthyl]sulfonyl}acétate de méthyle [French] [ACD/IUPAC Name]
Acetic acid, 2-[[(3-ethyl-5-isoxazolyl)methyl]sulfonyl]-, methyl ester [ACD/Index Name]
Methyl {[(3-ethyl-1,2-oxazol-5-yl)methyl]sulfonyl}acetate [ACD/IUPAC Name]
Methyl-{[(3-ethyl-1,2-oxazol-5-yl)methyl]sulfonyl}acetat [German] [ACD/IUPAC Name]
1160246-40-1 [RN]
AGN-PC-07E383
AKOS005169068
MCULE-3885549386
methyl {[(3-ethylisoxazol-5-yl)methyl]sulfonyl}acetate
methyl 2-[(3-ethyl-1,2-oxazol-5-yl)methylsulfonyl]acetate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 461.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.2±3.0 kJ/mol
Flash Point: 232.7±28.7 °C
Index of Refraction: 1.500
Molar Refractivity: 55.5±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.11
ACD/LogD (pH 5.5): 0.41
ACD/BCF (pH 5.5): 1.21
ACD/KOC (pH 5.5): 39.95
ACD/LogD (pH 7.4): 0.41
ACD/BCF (pH 7.4): 1.21
ACD/KOC (pH 7.4): 39.95
Polar Surface Area: 95 Å2
Polarizability: 22.0±0.5 10-24cm3
Surface Tension: 47.9±3.0 dyne/cm
Molar Volume: 188.6±3.0 cm3

Click to predict properties on the Chemicalize site


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