4-(tert-butylthio)but-2-ynal C8H12OS structure

Flashcard maker : Lily Taylor

Molecular Formula C8H12OS
Average mass 156.245 Da
Density 1.0±0.1 g/cm3
Boiling Point 231.1±23.0 °C at 760 mmHg
Flash Point 87.7±12.7 °C
Molar Refractivity 45.3±0.3 cm3
Polarizability 17.9±0.5 10-24cm3
Surface Tension 37.1±3.0 dyne/cm
Molar Volume 155.2±3.0 cm3
  • Predicted – ACD/Labs
  • Predicted – ChemAxon

Predicted data is generated using the ACD/Labs Percepta Platform – PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 231.1±23.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 46.8±3.0 kJ/mol
Flash Point: 87.7±12.7 °C
Index of Refraction: 1.495
Molar Refractivity: 45.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.99
ACD/LogD (pH 5.5): 2.58
ACD/BCF (pH 5.5): 53.32
ACD/KOC (pH 5.5): 599.42
ACD/LogD (pH 7.4): 2.58
ACD/BCF (pH 7.4): 53.32
ACD/KOC (pH 7.4): 599.42
Polar Surface Area: 42 Å2
Polarizability: 17.9±0.5 10-24cm3
Surface Tension: 37.1±3.0 dyne/cm
Molar Volume: 155.2±3.0 cm3

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