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Search term: C9H16O3S (Found by molecular formula)
ChemSpider 2D Image | 3-Isobutyltetrahydro-3-thiophenecarbaldehyde 1,1-dioxide | C9H16O3S

3-Isobutyltetrahydro-3-thiophenecarbaldehyde 1,1-dioxide

  • Molecular FormulaC9H16O3S
  • Average mass204.286 Da
  • Monoisotopic mass204.082016 Da
  • ChemSpider ID61478394

More details:

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

1,1-Dioxyde de 3-isobutyltétrahydro-3-thiophènecarbaldéhyde [French] [ACD/IUPAC Name]
3-Isobutyltetrahydro-3-thiophencarbaldehyd-1,1-dioxid [German] [ACD/IUPAC Name]
3-Isobutyltetrahydro-3-thiophenecarbaldehyde 1,1-dioxide [ACD/IUPAC Name]
3-Thiophenecarboxaldehyde, tetrahydro-3-(2-methylpropyl)-, 1,1-dioxide [ACD/Index Name]
1934654-10-0 [RN]
3-(2-methylpropyl)-1,1-dioxo-1λ6-thiolane-3-carbaldehyde

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

Density: 1.2±0.1 g/cm3
Boiling Point: 355.5±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.1±3.0 kJ/mol
Flash Point: 205.2±18.6 °C
Index of Refraction: 1.505
Molar Refractivity: 50.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.68
ACD/LogD (pH 5.5): 0.93
ACD/BCF (pH 5.5): 3.00
ACD/KOC (pH 5.5): 76.37
ACD/LogD (pH 7.4): 0.93
ACD/BCF (pH 7.4): 3.00
ACD/KOC (pH 7.4): 76.37
Polar Surface Area: 60 Å2
Polarizability: 20.1±0.5 10-24cm3
Surface Tension: 40.9±3.0 dyne/cm
Molar Volume: 171.3±3.0 cm3

Click to predict properties on the Chemicalize site


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