ChemSpider 2D Image | Isobutyl (1,1-dioxido-2,3-dihydro-3-thiophenyl)acetate | C10H16O4S

Isobutyl (1,1-dioxido-2,3-dihydro-3-thiophenyl)acetate

  • Molecular FormulaC10H16O4S
  • Average mass232.297 Da
  • Monoisotopic mass232.076935 Da
  • ChemSpider ID30590040

More details:

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

(1,1-Dioxydo-2,3-dihydro-3-thiophényl)acétate d'isobutyle [French] [ACD/IUPAC Name]
3-Thiopheneacetic acid, 2,3-dihydro-, 2-methylpropyl ester, 1,1-dioxide [ACD/Index Name]
Isobutyl (1,1-dioxido-2,3-dihydro-3-thiophenyl)acetate [ACD/IUPAC Name]
Isobutyl-(1,1-dioxido-2,3-dihydro-3-thiophenyl)acetat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 376.1±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.4±3.0 kJ/mol
Flash Point: 181.3±22.1 °C
Index of Refraction: 1.492
Molar Refractivity: 56.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.98
ACD/LogD (pH 5.5): 1.28
ACD/BCF (pH 5.5): 5.56
ACD/KOC (pH 5.5): 118.78
ACD/LogD (pH 7.4): 1.28
ACD/BCF (pH 7.4): 5.56
ACD/KOC (pH 7.4): 118.78
Polar Surface Area: 69 Å2
Polarizability: 22.5±0.5 10-24cm3
Surface Tension: 38.9±3.0 dyne/cm
Molar Volume: 196.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement