ChemSpider 2D Image | 4-Isopropyl-5-methyl-2,3-dihydrothiophene 1,1-dioxide | C8H14O2S

4-Isopropyl-5-methyl-2,3-dihydrothiophene 1,1-dioxide

  • Molecular FormulaC8H14O2S
  • Average mass174.261 Da
  • Monoisotopic mass174.071457 Da
  • ChemSpider ID24211632

More details:

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

1,1-Dioxyde de 4-isopropyl-5-méthyl-2,3-dihydrothiophène [French] [ACD/IUPAC Name]
104664-82-6 [RN]
4-Isopropyl-5-methyl-2,3-dihydrothiophen-1,1-dioxid [German] [ACD/IUPAC Name]
4-Isopropyl-5-methyl-2,3-dihydrothiophene 1,1-dioxide [ACD/IUPAC Name]
Thiophene, 2,3-dihydro-5-methyl-4-(1-methylethyl)-, 1,1-dioxide [ACD/Index Name]
Thiophene, 2,3-dihydro-5-methyl-4-(1-methylethyl)-, 1,1-dioxide (9CI)

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

Density: 1.1±0.1 g/cm3
Boiling Point: 311.2±12.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.0±3.0 kJ/mol
Flash Point: 168.4±12.2 °C
Index of Refraction: 1.490
Molar Refractivity: 45.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.67
ACD/LogD (pH 5.5): 1.66
ACD/BCF (pH 5.5): 10.77
ACD/KOC (pH 5.5): 190.70
ACD/LogD (pH 7.4): 1.66
ACD/BCF (pH 7.4): 10.77
ACD/KOC (pH 7.4): 190.70
Polar Surface Area: 43 Å2
Polarizability: 18.0±0.5 10-24cm3
Surface Tension: 34.1±3.0 dyne/cm
Molar Volume: 156.7±3.0 cm3

Click to predict properties on the Chemicalize site


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