ChemSpider 2D Image | 4-Methyl-2-thiopheneol | C5H6OS

4-Methyl-2-thiopheneol

  • Molecular FormulaC5H6OS
  • Average mass114.165 Da
  • Monoisotopic mass114.013931 Da
  • ChemSpider ID27461042

More details:

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

2-Thiopheneol, 4-methyl- [ACD/Index Name]
4-Methyl-2-thiopheneol [ACD/IUPAC Name]
4-Méthyl-2-thiophèneol [French] [ACD/IUPAC Name]
4-Methyl-2-thiophenol [German] [ACD/IUPAC Name]
2-Hydroxy-4-methylthiophene
35983-75-6 [RN]
4-methylthiophen-2-ol
89323-39-7 [RN]
MFCD17078946

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

Density: 1.2±0.1 g/cm3
Boiling Point: 232.7±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.8±3.0 kJ/mol
Flash Point: 94.5±21.8 °C
Index of Refraction: 1.584
Molar Refractivity: 31.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.29
ACD/LogD (pH 5.5): 1.79
ACD/BCF (pH 5.5): 13.59
ACD/KOC (pH 5.5): 225.29
ACD/LogD (pH 7.4): 1.76
ACD/BCF (pH 7.4): 12.69
ACD/KOC (pH 7.4): 210.26
Polar Surface Area: 48 Å2
Polarizability: 12.4±0.5 10-24cm3
Surface Tension: 45.5±3.0 dyne/cm
Molar Volume: 93.6±3.0 cm3

Click to predict properties on the Chemicalize site


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