ChemSpider 2D Image | 1-{[1-(Butylsulfanyl)-2-propanyl]oxy}-2-propanol | C10H22O2S

1-{[1-(Butylsulfanyl)-2-propanyl]oxy}-2-propanol

  • Molecular FormulaC10H22O2S
  • Average mass206.346 Da
  • Monoisotopic mass206.134048 Da
  • ChemSpider ID28670808

More details:

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

1-{[1-(Butylsulfanyl)-2-propanyl]oxy}-2-propanol [German] [ACD/IUPAC Name]
1-{[1-(Butylsulfanyl)-2-propanyl]oxy}-2-propanol [ACD/IUPAC Name]
1-{[1-(Butylsulfanyl)-2-propanyl]oxy}-2-propanol [French] [ACD/IUPAC Name]
2-Propanol, 1-[2-(butylthio)-1-methylethoxy]- [ACD/Index Name]
1-{[1-(BUTYLSULFANYL)PROPAN-2-YL]OXY}PROPAN-2-OL
111290-07-4 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 302.1±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 62.9±6.0 kJ/mol
Flash Point: 136.5±22.3 °C
Index of Refraction: 1.473
Molar Refractivity: 59.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.36
ACD/LogD (pH 5.5): 2.28
ACD/BCF (pH 5.5): 31.91
ACD/KOC (pH 5.5): 415.08
ACD/LogD (pH 7.4): 2.28
ACD/BCF (pH 7.4): 31.91
ACD/KOC (pH 7.4): 415.08
Polar Surface Area: 55 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 33.8±3.0 dyne/cm
Molar Volume: 212.2±3.0 cm3

Click to predict properties on the Chemicalize site


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