ChemicalBook--->CAS DataBase List--->52429-99-9

52429-99-9

52429-99-9 Structure

52429-99-9 Structure
IdentificationBack Directory
[Name]

PHOSPHORIC ACID TRIS(8-QUINOLYL ESTER)
[CAS]

52429-99-9
[Synonyms]

Einecs 257-908-7
TRIQUINOL-8-YL PHOSPHATE
Tri(8-quinolyl) phosphate
triquinolin-8-yl phosphate
PHOSPHORIC ACID TRIS(8-QUINOLYL ESTER)
8-Quinolinol, phosphate (3:1) (ester) (9CI)
Tri(8-quinolyl) phosphate purum, >=95.0% (N)
[EINECS(EC#)]

257-908-7
[Molecular Formula]

C27H18N3O4P
[MDL Number]

MFCD00042802
[MOL File]

52429-99-9.mol
[Molecular Weight]

479.42
Chemical PropertiesBack Directory
[Melting point ]

193-197 °C
[storage temp. ]

2-8°C
[form ]

powder
[BRN ]

369269
[InChI]

1S/C27H18N3O4P/c31-35(32-22-13-1-7-19-10-4-16-28-25(19)22,33-23-14-2-8-20-11-5-17-29-26(20)23)34-24-15-3-9-21-12-6-18-30-27(21)24/h1-18H
[InChIKey]

RFZXFOYQOFYOKR-UHFFFAOYSA-N
[SMILES]

O=P(Oc1cccc2cccnc12)(Oc3cccc4cccnc34)Oc5cccc6cccnc56
Safety DataBack Directory
[WGK Germany ]

3
[F ]

10-21
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Purification Methods]

Purify it by recrystallisation from dimethylformamide. The purity is checked by paper chromatography, RF 0.90 [i-PrOH/saturated (NH4)2SO4/H2O, 2:79:19 as eluent], IR (KBr) 16201570 ( C=C, C=N) and max 1253 (P=) cm-1.[Takaku et al. ull Chem Soc Jpn 47 779 1974.]
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