ChemSpider 2D Image | [(2S)-2-Methyl-5-oxo-2,5-dihydro-2-furanyl]acetic acid | C7H8O4

[(2S)-2-Methyl-5-oxo-2,5-dihydro-2-furanyl]acetic acid

  • Molecular FormulaC7H8O4
  • Average mass156.136 Da
  • Monoisotopic mass156.042252 Da
  • ChemSpider ID25057604

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

[(2S)-2-Methyl-5-oxo-2,5-dihydro-2-furanyl]acetic acid [ACD/IUPAC Name]
[(2S)-2-Methyl-5-oxo-2,5-dihydro-2-furanyl]essigsäure [German] [ACD/IUPAC Name]
[(2s)-2-Methyl-5-Oxo-2,5-Dihydrofuran-2-Yl]acetic Acid
2-Furanacetic acid, 2,5-dihydro-2-methyl-5-oxo-, (2S)- [ACD/Index Name]
Acide [(2S)-2-méthyl-5-oxo-2,5-dihydro-2-furanyl]acétique [French] [ACD/IUPAC Name]
32150-78-0 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 391.5±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 70.4±6.0 kJ/mol
Flash Point: 170.2±13.9 °C
Index of Refraction: 1.499
Molar Refractivity: 35.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.62
ACD/LogD (pH 5.5): -1.90
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 64 Å2
Polarizability: 14.0±0.5 10-24cm3
Surface Tension: 45.6±3.0 dyne/cm
Molar Volume: 120.2±3.0 cm3

Click to predict properties on the Chemicalize site


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