Found 777 results

Search term: MF = 'C_{11}H_{18}OS'
ChemSpider 2D Image | 1-[3-(Tetrahydro-2H-thiopyran-4-yl)cyclobutyl]ethanone | C11H18OS

1-[3-(Tetrahydro-2H-thiopyran-4-yl)cyclobutyl]ethanone

  • Molecular FormulaC11H18OS
  • Average mass198.325 Da
  • Monoisotopic mass198.107834 Da
  • ChemSpider ID45630735

More details:

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

1-[3-(Tetrahydro-2H-thiopyran-4-yl)cyclobutyl]ethanon [German] [ACD/IUPAC Name]
1-[3-(Tetrahydro-2H-thiopyran-4-yl)cyclobutyl]ethanone [ACD/IUPAC Name]
1-[3-(Tétrahydro-2H-thiopyrane-4-yl)cyclobutyl]éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[3-(tetrahydro-2H-thiopyran-4-yl)cyclobutyl]- [ACD/Index Name]
1781867-19-3 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 307.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 54.8±3.0 kJ/mol
Flash Point: 149.9±13.6 °C
Index of Refraction: 1.539
Molar Refractivity: 56.9±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.84
ACD/LogD (pH 5.5): 2.98
ACD/BCF (pH 5.5): 109.13
ACD/KOC (pH 5.5): 1000.84
ACD/LogD (pH 7.4): 2.98
ACD/BCF (pH 7.4): 109.13
ACD/KOC (pH 7.4): 1000.84
Polar Surface Area: 42 Å2
Polarizability: 22.6±0.5 10-24cm3
Surface Tension: 42.1±3.0 dyne/cm
Molar Volume: 181.8±3.0 cm3

Click to predict properties on the Chemicalize site


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