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Search term: MF = 'C_{9}H_{20}OS'
ChemSpider 2D Image | 1-(Isobutylsulfinyl)pentane | C9H20OS

1-(Isobutylsulfinyl)pentane

  • Molecular FormulaC9H20OS
  • Average mass176.320 Da
  • Monoisotopic mass176.123489 Da
  • ChemSpider ID60163030

More details:

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

1-(Isobutylsulfinyl)pentan [German] [ACD/IUPAC Name]
1-(Isobutylsulfinyl)pentane [ACD/IUPAC Name]
1-(Isobutylsulfinyl)pentane [French] [ACD/IUPAC Name]
Pentane, 1-[(2-methylpropyl)sulfinyl]- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 287.0±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 50.5±3.0 kJ/mol
Flash Point: 127.4±18.7 °C
Index of Refraction: 1.474
Molar Refractivity: 52.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.18
ACD/LogD (pH 5.5): 2.90
ACD/BCF (pH 5.5): 93.85
ACD/KOC (pH 5.5): 898.41
ACD/LogD (pH 7.4): 2.90
ACD/BCF (pH 7.4): 93.85
ACD/KOC (pH 7.4): 898.41
Polar Surface Area: 36 Å2
Polarizability: 20.8±0.5 10-24cm3
Surface Tension: 36.2±3.0 dyne/cm
Molar Volume: 187.0±3.0 cm3

Click to predict properties on the Chemicalize site


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