ChemSpider 2D Image | Tetrahydro-3H-pyrrolo[1,2-c][1,2,3]oxathiazole 1,1-dioxide | C5H9NO3S

Tetrahydro-3H-pyrrolo[1,2-c][1,2,3]oxathiazole 1,1-dioxide

  • Molecular FormulaC5H9NO3S
  • Average mass163.195 Da
  • Monoisotopic mass163.030319 Da
  • ChemSpider ID14464400

More details:

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

1,1-Dioxyde de tétrahydro-3H-pyrrolo[1,2-c][1,2,3]oxathiazole [French] [ACD/IUPAC Name]
143577-49-5 [RN]
3H-Pyrrolo[1,2-c][1,2,3]oxathiazole, tetrahydro-, 1,1-dioxide [ACD/Index Name]
Tetrahydro-3H-pyrrolo[1,2-c][1,2,3]oxathiazol-1,1-dioxid [German] [ACD/IUPAC Name]
Tetrahydro-3H-pyrrolo[1,2-c][1,2,3]oxathiazole 1,1-dioxide [ACD/IUPAC Name]
3a,4,5,6-Tetrahydro-3H-pyrrolo[1,2-c]oxathiazole 1,1-dioxide
4,5,6-Tetrahydro-3H-pyrrolo[1,2-c]oxathiazole 1,1-dioxide
methyl 2-(4-aminotetrahydropyran-4-yl)acetate
MFCD22123262 [MDL number]
MFCD24526505
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.0 g/cm3
Boiling Point: 254.9±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 49.2±0.0 kJ/mol
Flash Point: 108.0±0.0 °C
Index of Refraction: 1.574
Molar Refractivity: 35.5±0.0 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -1.14
ACD/LogD (pH 5.5): -1.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.71
ACD/LogD (pH 7.4): -1.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.71
Polar Surface Area: 55 Å2
Polarizability: 14.1±0.0 10-24cm3
Surface Tension: 57.0±0.0 dyne/cm
Molar Volume: 107.5±0.0 cm3

Click to predict properties on the Chemicalize site


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