ChemSpider 2D Image | 3-(5-Methoxy-2-thienyl)-2-butanol | C9H14O2S

3-(5-Methoxy-2-thienyl)-2-butanol

  • Molecular FormulaC9H14O2S
  • Average mass186.271 Da
  • Monoisotopic mass186.071457 Da
  • ChemSpider ID60958003

More details:

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

2-Thiopheneethanol, 5-methoxy-α,β-dimethyl- [ACD/Index Name]
3-(5-Methoxy-2-thienyl)-2-butanol [German] [ACD/IUPAC Name]
3-(5-Methoxy-2-thienyl)-2-butanol [ACD/IUPAC Name]
3-(5-Méthoxy-2-thiényl)-2-butanol [French] [ACD/IUPAC Name]
1864479-15-1 [RN]
3-(5-methoxythiophen-2-yl)butan-2-ol

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

Density: 1.1±0.1 g/cm3
Boiling Point: 280.6±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.9±3.0 kJ/mol
Flash Point: 123.5±24.6 °C
Index of Refraction: 1.529
Molar Refractivity: 51.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.97
ACD/LogD (pH 5.5): 2.03
ACD/BCF (pH 5.5): 20.55
ACD/KOC (pH 5.5): 302.94
ACD/LogD (pH 7.4): 2.03
ACD/BCF (pH 7.4): 20.55
ACD/KOC (pH 7.4): 302.94
Polar Surface Area: 58 Å2
Polarizability: 20.5±0.5 10-24cm3
Surface Tension: 38.2±3.0 dyne/cm
Molar Volume: 167.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement