ChemSpider 2D Image | 3-[(2-Methyl-3-furyl)sulfanyl]-2-butanol | C9H14O2S

3-[(2-Methyl-3-furyl)sulfanyl]-2-butanol

  • Molecular FormulaC9H14O2S
  • Average mass186.271 Da
  • Monoisotopic mass186.071457 Da
  • ChemSpider ID55823341

More details:

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

2-Butanol, 3-[(2-methyl-3-furanyl)thio]- [ACD/Index Name]
3-[(2-Methyl-3-furyl)sulfanyl]-2-butanol [German] [ACD/IUPAC Name]
3-[(2-Methyl-3-furyl)sulfanyl]-2-butanol [ACD/IUPAC Name]
3-[(2-Méthyl-3-furyl)sulfanyl]-2-butanol [French] [ACD/IUPAC Name]
3-[(2-Methylfuran-3-yl)sulfanyl]butan-2-ol
59190-24-8 [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: 262.1±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.8±3.0 kJ/mol
Flash Point: 112.3±25.9 °C
Index of Refraction: 1.534
Molar Refractivity: 51.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.22
ACD/LogD (pH 5.5): 2.15
ACD/BCF (pH 5.5): 25.58
ACD/KOC (pH 5.5): 354.32
ACD/LogD (pH 7.4): 2.15
ACD/BCF (pH 7.4): 25.58
ACD/KOC (pH 7.4): 354.32
Polar Surface Area: 59 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 41.2±5.0 dyne/cm
Molar Volume: 166.9±5.0 cm3

Click to predict properties on the Chemicalize site


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