Tetrabenzyl pyrophosphate - CAS 990-91-0
Catalog: |
BB042256 |
Product Name: |
Tetrabenzyl pyrophosphate |
CAS: |
990-91-0 |
Synonyms: |
dibenzyl bis(phenylmethoxy)phosphoryl phosphate |
IUPAC Name: | dibenzyl bis(phenylmethoxy)phosphoryl phosphate |
Description: | Tetrabenzyl pyrophosphate (CAS# 990-91-0) is a phosphorylating reagent. |
Molecular Weight: | 538.47 |
Molecular Formula: | C28H28O7P2 |
Canonical SMILES: | C1=CC=C(C=C1)COP(=O)(OCC2=CC=CC=C2)OP(=O)(OCC3=CC=CC=C3)OCC4=CC=CC=C4 |
InChI: | InChI=1S/C28H28O7P2/c29-36(31-21-25-13-5-1-6-14-25,32-22-26-15-7-2-8-16-26)35-37(30,33-23-27-17-9-3-10-18-27)34-24-28-19-11-4-12-20-28/h1-20H,21-24H2 |
InChI Key: | NSBNXCZCLRBQTA-UHFFFAOYSA-N |
Boiling Point: | 601.6 °C at 760 mmHg |
Melting Point: | 63-66 °C |
Purity: | > 98.0 % (LC) |
Density: | 1.289 g/cm3 |
Appearance: | White solid |
Storage: | -20 °C |
MDL: | MFCD00051941 |
LogP: | 8.08640 |
Publication Number | Title | Priority Date |
CN-112500441-A | Preparation process of high-purity glycosyl phosphate | 20201220 |
CN-112552345-A | Preparation method of NK-1 receptor antagonist | 20201218 |
CN-112480172-A | Use of borane-pyridine complexes for the preparation of pharmaceutical compounds | 20201202 |
CN-112300212-A | Use of borane-pyridine complexes for the preparation of NK-1 receptor antagonists | 20201130 |
CN-112175023-A | Preparation method of fatty alcohol acetyl chitobiose and fatty alcohol N-acetylglucosamine | 20201031 |
PMID | Publication Date | Title | Journal |
22364416 | 20120308 | Identification, design and biological evaluation of bisaryl quinolones targeting Plasmodium falciparum type II NADH:quinone oxidoreductase (PfNDH2) | Journal of medicinal chemistry |
22364417 | 20120308 | Identification, design and biological evaluation of heterocyclic quinolones targeting Plasmodium falciparum type II NADH:quinone oxidoreductase (PfNDH2) | Journal of medicinal chemistry |
22573991 | 20090101 | Thiopental and Phenytoin as Novel Ionophores for Potentiometric Determination of Lead (II) Ions | Sensors (Basel, Switzerland) |
18513706 | 20080721 | Synthesis of a tetrasaccharide phosphate from the linkage region of the arabinogalactan-peptidoglycan complex in the mycobacterial cell wall | Carbohydrate research |
19812733 | 20070906 | FTY720 story. Its discovery and the following accelerated development of sphingosine 1-phosphate receptor agonists as immunomodulators based on reverse pharmacology | Perspectives in medicinal chemistry |
Complexity: | 612 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 538.13102722 |
Formal Charge: | 0 |
Heavy Atom Count: | 37 |
Hydrogen Bond Acceptor Count: | 7 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 538.13102722 |
Rotatable Bond Count: | 14 |
Topological Polar Surface Area: | 80.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.9 |
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