ChemSpider 2D Image | 1-(3-Hydroxy-5-methyl-2-thienyl)ethanone | C7H8O2S

1-(3-Hydroxy-5-methyl-2-thienyl)ethanone

  • Molecular FormulaC7H8O2S
  • Average mass156.202 Da
  • Monoisotopic mass156.024506 Da
  • ChemSpider ID21105919

More details:

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

1-(3-Hydroxy-5-methyl-2-thienyl)ethanon [German] [ACD/IUPAC Name]
1-(3-Hydroxy-5-methyl-2-thienyl)ethanone [ACD/IUPAC Name]
1-(3-Hydroxy-5-méthyl-2-thiényl)éthanone [French] [ACD/IUPAC Name]
133860-42-1 [RN]
Ethanone, 1-(3-hydroxy-5-methyl-2-thienyl)- [ACD/Index Name]
1-(3-hydroxy-5-methyl-2-thienyl) ethanone
1-(3-Hydroxy-5-methyl-2-thienyl)-ethanone
1-(3-hydroxy-5-methylthiophen-2-yl)ethan-1-one
1-(3-hydroxy-5-methylthiophen-2-yl)ethanone
Ethanone, 1-(3-hydroxy-5-methyl-2-thienyl)- (9CI)
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

U0W0KQ1EET [DBID]
UNII:U0W0KQ1EET [DBID]
UNII-U0W0KQ1EET [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 272.4±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.1±3.0 kJ/mol
Flash Point: 118.5±25.9 °C
Index of Refraction: 1.575
Molar Refractivity: 41.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.01
ACD/LogD (pH 5.5): 2.20
ACD/BCF (pH 5.5): 27.92
ACD/KOC (pH 5.5): 377.27
ACD/LogD (pH 7.4): 2.20
ACD/BCF (pH 7.4): 27.85
ACD/KOC (pH 7.4): 376.32
Polar Surface Area: 66 Å2
Polarizability: 16.4±0.5 10-24cm3
Surface Tension: 47.3±3.0 dyne/cm
Molar Volume: 125.1±3.0 cm3

Click to predict properties on the Chemicalize site


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