ChemSpider 2D Image | N~2~-(1,1-Dioxidotetrahydro-3-thiophenyl)asparagine | C8H14N2O5S

N2-(1,1-Dioxidotetrahydro-3-thiophenyl)asparagine

  • Molecular FormulaC8H14N2O5S
  • Average mass250.272 Da
  • Monoisotopic mass250.062347 Da
  • ChemSpider ID21785242

More details:

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

Asparagine, N2-(tetrahydro-1,1-dioxido-3-thienyl)- [ACD/Index Name]
N2-(1,1-Dioxidotetrahydro-3-thiophenyl)asparagin [German] [ACD/IUPAC Name]
N2-(1,1-Dioxidotetrahydro-3-thiophenyl)asparagine [ACD/IUPAC Name]
N2-(1,1-Dioxidotetrahydrothiophen-3-yl)asparagine
N2-(1,1-Dioxydotétrahydro-3-thiophényl)asparagine [French] [ACD/IUPAC Name]
2-(1,1-Dioxo-tetrahydro-1λ*6*-thiophen-3-ylamino)-succinamic acid

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

Density: 1.5±0.1 g/cm3
Boiling Point: 658.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.3 mmHg at 25°C
Enthalpy of Vaporization: 105.8±6.0 kJ/mol
Flash Point: 352.3±31.5 °C
Index of Refraction: 1.572
Molar Refractivity: 54.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -2.17
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): -4.83
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 135 Å2
Polarizability: 21.7±0.5 10-24cm3
Surface Tension: 69.8±5.0 dyne/cm
Molar Volume: 166.7±5.0 cm3

Click to predict properties on the Chemicalize site


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