ChemSpider 2D Image | 4-{[Dimethyl(2-methyl-2-propanyl)silyl]oxy}-3a,4,7,7a-tetrahydro-1-benzothiophen-3(2H)-one 1,1-dioxide | C14H24O4SSi

4-{[Dimethyl(2-methyl-2-propanyl)silyl]oxy}-3a,4,7,7a-tetrahydro-1-benzothiophen-3(2H)-one 1,1-dioxide

  • Molecular FormulaC14H24O4SSi
  • Average mass316.488 Da
  • Monoisotopic mass316.116455 Da
  • ChemSpider ID28569699

More details:

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

1,1-Dioxyde de 4-{[diméthyl(2-méthyl-2-propanyl)silyl]oxy}-3a,4,7,7a-tétrahydro-1-benzothiophén-3(2H)-one [French] [ACD/IUPAC Name]
4-{[Dimethyl(2-methyl-2-propanyl)silyl]oxy}-3a,4,7,7a-tetrahydro-1-benzothiophen-3(2H)-on-1,1-dioxid [German] [ACD/IUPAC Name]
4-{[Dimethyl(2-methyl-2-propanyl)silyl]oxy}-3a,4,7,7a-tetrahydro-1-benzothiophen-3(2H)-one 1,1-dioxide [ACD/IUPAC Name]
Benzo[b]thiophen-3(2H)-one, 4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-3a,4,7,7a-tetrahydro-, 1,1-dioxide [ACD/Index Name]
(3AR,4S,7AR)-4-{[TERT-BUTYL(DIMETHYL)SILYL]OXY}-3A,4,7,7A-TETRAHYDRO-1-BENZOTHIOPHEN-3(2H)-ONE 1,1-DIOXIDE
147510-59-6 [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: 428.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.4±3.0 kJ/mol
Flash Point: 213.0±28.7 °C
Index of Refraction: 1.507
Molar Refractivity: 82.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.36
ACD/LogD (pH 5.5): 2.07
ACD/BCF (pH 5.5): 22.20
ACD/KOC (pH 5.5): 320.09
ACD/LogD (pH 7.4): 2.07
ACD/BCF (pH 7.4): 22.20
ACD/KOC (pH 7.4): 320.09
Polar Surface Area: 69 Å2
Polarizability: 32.5±0.5 10-24cm3
Surface Tension: 35.7±5.0 dyne/cm
Molar Volume: 276.0±5.0 cm3

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