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Search term: C9H16O3S (Found by molecular formula)
ChemSpider 2D Image | 2-(1,1-Dioxidotetrahydro-3-thiophenyl)-2-methylbutanal | C9H16O3S

2-(1,1-Dioxidotetrahydro-3-thiophenyl)-2-methylbutanal

  • Molecular FormulaC9H16O3S
  • Average mass204.286 Da
  • Monoisotopic mass204.082016 Da
  • ChemSpider ID61446898

More details:

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

2-(1,1-Dioxidotetrahydro-3-thiophenyl)-2-methylbutanal [German] [ACD/IUPAC Name]
2-(1,1-Dioxidotetrahydro-3-thiophenyl)-2-methylbutanal [ACD/IUPAC Name]
2-(1,1-Dioxydotétrahydro-3-thiophényl)-2-méthylbutanal [French] [ACD/IUPAC Name]
3-Thiopheneacetaldehyde, α-ethyltetrahydro-α-methyl-, 1,1-dioxide [ACD/Index Name]
1936683-59-8 [RN]
2-(1,1-dioxo-1λ6-thiolan-3-yl)-2-methylbutanal

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

Density: 1.2±0.1 g/cm3
Boiling Point: 369.9±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.7±3.0 kJ/mol
Flash Point: 219.9±13.1 °C
Index of Refraction: 1.491
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: 0.10
ACD/LogD (pH 5.5): 0.69
ACD/BCF (pH 5.5): 1.97
ACD/KOC (pH 5.5): 56.51
ACD/LogD (pH 7.4): 0.69
ACD/BCF (pH 7.4): 1.97
ACD/KOC (pH 7.4): 56.51
Polar Surface Area: 60 Å2
Polarizability: 20.1±0.5 10-24cm3
Surface Tension: 41.0±3.0 dyne/cm
Molar Volume: 175.4±3.0 cm3

Click to predict properties on the Chemicalize site


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