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Search term: JIHPTULEFOYNCY-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | {2-[1-(3-Fluoro-4-hydroxyphenyl)-1H-1,2,3-triazol-4-yl]-8-oxo-1,7-naphthyridin-7(8H)-yl}acetic acid | C18H12FN5O4

{2-[1-(3-Fluoro-4-hydroxyphenyl)-1H-1,2,3-triazol-4-yl]-8-oxo-1,7-naphthyridin-7(8H)-yl}acetic acid

  • Molecular FormulaC18H12FN5O4
  • Average mass381.317 Da
  • Monoisotopic mass381.087341 Da
  • ChemSpider ID90617684

More details:

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

{2-[1-(3-Fluor-4-hydroxyphenyl)-1H-1,2,3-triazol-4-yl]-8-oxo-1,7-naphthyridin-7(8H)-yl}essigsäure [German] [ACD/IUPAC Name]
{2-[1-(3-Fluoro-4-hydroxyphenyl)-1H-1,2,3-triazol-4-yl]-8-oxo-1,7-naphthyridin-7(8H)-yl}acetic acid [ACD/IUPAC Name]
1,7-Naphthyridine-7(8H)-acetic acid, 2-[1-(3-fluoro-4-hydroxyphenyl)-1H-1,2,3-triazol-4-yl]-8-oxo- [ACD/Index Name]
Acide {2-[1-(3-fluoro-4-hydroxyphényl)-1H-1,2,3-triazol-4-yl]-8-oxo-1,7-naphtyridin-7(8H)-yl}acétique [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 740.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.3±3.0 kJ/mol
Flash Point: 401.4±35.7 °C
Index of Refraction: 1.745
Molar Refractivity: 95.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.98
ACD/LogD (pH 5.5): -1.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 121 Å2
Polarizability: 37.9±0.5 10-24cm3
Surface Tension: 69.2±7.0 dyne/cm
Molar Volume: 235.9±7.0 cm3

Click to predict properties on the Chemicalize site


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