ChemSpider 2D Image | 3,4-Dimethyl-7-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]-2H-chromen-2-one | C15H14N2O4

3,4-Dimethyl-7-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]-2H-chromen-2-one

  • Molecular FormulaC15H14N2O4
  • Average mass286.283 Da
  • Monoisotopic mass286.095367 Da
  • ChemSpider ID23117131

More details:

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

2H-1-Benzopyran-2-one, 3,4-dimethyl-7-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]- [ACD/Index Name]
3,4-Dimethyl-7-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]-2H-chromen-2-on [German] [ACD/IUPAC Name]
3,4-Dimethyl-7-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]-2H-chromen-2-one [ACD/IUPAC Name]
3,4-Diméthyl-7-[(5-méthyl-1,3,4-oxadiazol-2-yl)méthoxy]-2H-chromén-2-one [French] [ACD/IUPAC Name]
3,4-Dimethyl-7-(5-methyl-[1,3,4]oxadiazol-2-ylmethoxy)-chromen-2-one

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

Density: 1.3±0.1 g/cm3
Boiling Point: 501.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.0±3.0 kJ/mol
Flash Point: 256.8±32.9 °C
Index of Refraction: 1.574
Molar Refractivity: 73.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.21
ACD/LogD (pH 5.5): 2.61
ACD/BCF (pH 5.5): 56.56
ACD/KOC (pH 5.5): 625.24
ACD/LogD (pH 7.4): 2.61
ACD/BCF (pH 7.4): 56.56
ACD/KOC (pH 7.4): 625.24
Polar Surface Area: 74 Å2
Polarizability: 29.2±0.5 10-24cm3
Surface Tension: 50.6±3.0 dyne/cm
Molar Volume: 223.3±3.0 cm3

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