Tri(8-quinolyl) phosphate - CAS 52429-99-9
Catalog: |
BB027824 |
Product Name: |
Tri(8-quinolyl) phosphate |
CAS: |
52429-99-9 |
Synonyms: |
triquinolin-8-yl phosphate |
IUPAC Name: | triquinolin-8-yl phosphate |
Description: | Tri(8-quinolyl) phosphate (CAS# 52429-99-9 ) is a useful research chemical. |
Molecular Weight: | 479.42 |
Molecular Formula: | C27H18N3O4P |
Canonical SMILES: | C1=CC2=C(C(=C1)OP(=O)(OC3=CC=CC4=C3N=CC=C4)OC5=CC=CC6=C5N=CC=C6)N=CC=C2 |
InChI: | 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 |
InChI Key: | RFZXFOYQOFYOKR-UHFFFAOYSA-N |
Boiling Point: | 638.7 °C at 760 mmHg |
Melting Point: | 193-197 °C |
Purity: | 95 % |
Density: | 1.41 g/cm3 |
LogP: | 6.97610 |
Publication Number | Title | Priority Date |
KR-101701881-B1 | Functional composition for surface modification | 20151111 |
JP-2002179694-A | Phosphate derivative and pharmaceutical composition | 19980619 |
WO-9965525-A1 | Ocular tension lowering agents and phosphoric ester derivatives | 19980619 |
EP-0852233-A1 | Cyclosporin phosphate derivatives and medicinal composition | 19950921 |
JP-H07278187-A | Phosphate ester derivative of cyclosporins and pharmaceutical composition | 19940407 |
Complexity: | 661 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 479.10349306 |
Formal Charge: | 0 |
Heavy Atom Count: | 35 |
Hydrogen Bond Acceptor Count: | 7 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 479.10349306 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 83.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5.8 |
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