| Melting point |
175-177°C |
| Density |
0.002g/cm3 at 21℃ |
| vapor pressure |
<1.3 × 10-6(Pa at 20 °C) |
| storage temp. |
0-6°C |
| solubility |
Solubility in organic solvents (g/l at 25 °C)
Acetone 17.0
Ethyl acetate 3.8
n-Hexane <0.001
Methanol 50.0
Octanol 4.4
Toluene <0.001
Acetone 17.0 |
| pka |
Dissociation constant (pKa at 20 °C) 4.76 |
| color |
White |
| Water Solubility |
Solubility in water (g/l at 25 °C) 0.063 (pH 5) 5.016 (pH 7) 25.7 (pH 7.4) |
| InChI |
InChI=1S/C14H14F3N5O6S.Na/c1-26-9-6-10(27-2)20-12(19-9)21-13(23)22-29(24,25)11-8(4-3-5-18-11)28-7-14(15,16)17;/h3-6H,7H2,1-2H3,(H2,19,20,21,22,23);/q;+1/p-1 |
| InChIKey |
UFEIWEXHHOXPGP-UHFFFAOYSA-M |
| SMILES |
S(=O)(=O)(C1=C(C=CC=N1)OCC(F)(F)F)N([Na])C(=O)NC1=NC(OC)=CC(OC)=N1 |
| LogP |
-1.6-1.4 at 25℃ and pH5-9.1 |
| Surface tension |
65.8mN/m at 1g/L and 20℃ |
| Dissociation constant |
4.76 at 20℃ |
| CAS DataBase Reference |
199119-58-9(CAS DataBase Reference) |
