ChemSpider 2D Image | N-[(1,1-Dioxidotetrahydro-3-thiophenyl)carbonyl]-N-ethylglycine | C9H15NO5S

N-[(1,1-Dioxidotetrahydro-3-thiophenyl)carbonyl]-N-ethylglycine

  • Molecular FormulaC9H15NO5S
  • Average mass249.284 Da
  • Monoisotopic mass249.067093 Da
  • ChemSpider ID26426672

More details:

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

Glycine, N-ethyl-N-[(tetrahydro-1,1-dioxido-3-thienyl)carbonyl]- [ACD/Index Name]
N-[(1,1-Dioxidotetrahydro-3-thiophenyl)carbonyl]-N-ethylglycin [German] [ACD/IUPAC Name]
N-[(1,1-Dioxidotetrahydro-3-thiophenyl)carbonyl]-N-ethylglycine [ACD/IUPAC Name]
N-[(1,1-Dioxydotétrahydro-3-thiophényl)carbonyl]-N-éthylglycine [French] [ACD/IUPAC Name]
2-[(1,1-dioxo-1λ6-thiolan-3-yl)-N-ethylformamido]acetic acid
2-[(1,1-dioxo-1λ6-thiolan-3-yl)-N-ethylformamido]acetic acid

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

Density: 1.4±0.1 g/cm3
Boiling Point: 552.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 91.1±6.0 kJ/mol
Flash Point: 287.9±30.1 °C
Index of Refraction: 1.543
Molar Refractivity: 56.1±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.57
ACD/LogD (pH 5.5): -3.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 100 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 58.6±3.0 dyne/cm
Molar Volume: 177.9±3.0 cm3

Click to predict properties on the Chemicalize site


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