Found 43 results

Search term: MF = 'C_{17}H_{30}O_{3}S'
ChemSpider 2D Image | 4-(2-Methyl-2-butanyl)-2-[(tetrahydro-2-furanylmethyl)sulfanyl]cyclohexanecarboxylic acid | C17H30O3S

4-(2-Methyl-2-butanyl)-2-[(tetrahydro-2-furanylmethyl)sulfanyl]cyclohexanecarboxylic acid

  • Molecular FormulaC17H30O3S
  • Average mass314.483 Da
  • Monoisotopic mass314.191559 Da
  • ChemSpider ID53086035

More details:

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

4-(2-Methyl-2-butanyl)-2-[(tetrahydro-2-furanylmethyl)sulfanyl]cyclohexancarbonsäure [German] [ACD/IUPAC Name]
4-(2-Methyl-2-butanyl)-2-[(tetrahydro-2-furanylmethyl)sulfanyl]cyclohexanecarboxylic acid [ACD/IUPAC Name]
Acide 4-(2-méthyl-2-butanyl)-2-[(tétrahydro-2-furanylméthyl)sulfanyl]cyclohexanecarboxylique [French] [ACD/IUPAC Name]
Cyclohexanecarboxylic acid, 4-(1,1-dimethylpropyl)-2-[[(tetrahydro-2-furanyl)methyl]thio]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 454.2±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 78.2±6.0 kJ/mol
Flash Point: 228.5±24.6 °C
Index of Refraction: 1.522
Molar Refractivity: 88.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.94
ACD/LogD (pH 5.5): 3.46
ACD/BCF (pH 5.5): 141.51
ACD/KOC (pH 5.5): 605.51
ACD/LogD (pH 7.4): 1.66
ACD/BCF (pH 7.4): 2.23
ACD/KOC (pH 7.4): 9.55
Polar Surface Area: 72 Å2
Polarizability: 34.9±0.5 10-24cm3
Surface Tension: 42.2±5.0 dyne/cm
Molar Volume: 288.5±5.0 cm3

Click to predict properties on the Chemicalize site


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