ChemSpider 2D Image | 3a-Methyltetrahydropyrrolo[1,2-b][1,2]thiazol-3(2H)-one 1,1-dioxide | C7H11NO3S

3a-Methyltetrahydropyrrolo[1,2-b][1,2]thiazol-3(2H)-one 1,1-dioxide

  • Molecular FormulaC7H11NO3S
  • Average mass189.232 Da
  • Monoisotopic mass189.045959 Da
  • ChemSpider ID61823834

More details:

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

1,1-Dioxyde de 3a-méthyltétrahydropyrrolo[1,2-b][1,2]thiazol-3(2H)-one [French] [ACD/IUPAC Name]
3a-Methyltetrahydropyrrolo[1,2-b][1,2]thiazol-3(2H)-on-1,1-dioxid [German] [ACD/IUPAC Name]
3a-Methyltetrahydropyrrolo[1,2-b][1,2]thiazol-3(2H)-one 1,1-dioxide [ACD/IUPAC Name]
Pyrrolo[1,2-b]isothiazol-3(2H)-one, tetrahydro-3a-methyl-, 1,1-dioxide [ACD/Index Name]
2059987-02-7 [RN]
3a-methyl-hexahydro-1λ6-pyrrolo[1,2-b][1,2]thiazole-1,1,3-trione
MFCD30535941

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

Density: 1.4±0.1 g/cm3
Boiling Point: 329.7±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.2±3.0 kJ/mol
Flash Point: 153.2±30.7 °C
Index of Refraction: 1.573
Molar Refractivity: 43.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.66
ACD/LogD (pH 5.5): -0.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 21.05
ACD/LogD (pH 7.4): -0.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 21.05
Polar Surface Area: 63 Å2
Polarizability: 17.1±0.5 10-24cm3
Surface Tension: 56.0±5.0 dyne/cm
Molar Volume: 131.1±5.0 cm3

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