ChemSpider 2D Image | 2-(Hydroxymethyl)-6-methyl-4H-pyran-4-one | C7H8O3

2-(Hydroxymethyl)-6-methyl-4H-pyran-4-one

  • Molecular FormulaC7H8O3
  • Average mass140.137 Da
  • Monoisotopic mass140.047348 Da
  • ChemSpider ID24189593

More details:

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

2-(Hydroxymethyl)-6-methyl-4H-pyran-4-on [German] [ACD/IUPAC Name]
2-(Hydroxymethyl)-6-methyl-4H-pyran-4-one [ACD/IUPAC Name]
2-(Hydroxyméthyl)-6-méthyl-4H-pyran-4-one [French] [ACD/IUPAC Name]
4H-Pyran-4-one, 2-(hydroxymethyl)-6-methyl- [ACD/Index Name]
2-(HYDROXYMETHYL)-6-METHYLPYRAN-4-ONE
268226-14-8 [RN]
4H-Pyran-4-one, 2-(hydroxymethyl)-6-methyl- (9CI)
4H-PYRAN-4-ONE,2-(HYDROXYMETHYL)-6-METHYL-
MFCD18820216

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

Density: 1.2±0.1 g/cm3
Boiling Point: 327.8±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 66.1±6.0 kJ/mol
Flash Point: 142.8±15.8 °C
Index of Refraction: 1.519
Molar Refractivity: 34.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.70
ACD/LogD (pH 5.5): -0.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 20.29
ACD/LogD (pH 7.4): -0.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 20.29
Polar Surface Area: 47 Å2
Polarizability: 13.8±0.5 10-24cm3
Surface Tension: 40.8±3.0 dyne/cm
Molar Volume: 115.1±3.0 cm3

Click to predict properties on the Chemicalize site


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