5-Hydroxypyren-4-yl dimethyl phosphate
TL;DR: 5-Hydroxypyren-4-yl dimethyl phosphate (CAS 150993-62-7) is a chemical compound with molecular formula C18H15O5P and molecular weight 342.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-hydroxypyren-4-yl) dimethyl phosphate
Also Known As: 5-hydroxypyren-4-yl dimethyl phosphate, (5-hydroxypyren-4-yl) dimethyl phosphate, Phosphoric acid,5-hydroxy-4-pyrenyl dimethyl ester (8CI), 10-Undecen-1-ol,11-[[(1E)-10-bromo-1-decen-1-yl]sulfonyl]-,(10E)
| Molecular Formula | C18H15O5P |
|---|---|
| Molecular Weight | 342.07 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 65.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.0657 |
| Heavy Atoms | 24 |
| Complexity | 504.0 |
Chemical Identifiers
| CAS Number | 150993-62-7 |
|---|---|
| SMILES | COP(=O)(OC)OC1=C(C2=CC=CC3=C2C4=C(C=CC=C41)C=C3)O |
| InChIKey | HWCHZQZBNHUGGP-UHFFFAOYSA-N |
Product Overview
5-Hydroxypyren-4-yl dimethyl phosphate (CAS 150993-62-7), with molecular formula C18H15O5P and molecular weight 342.07 g/mol. IUPAC: (5-hydroxypyren-4-yl) dimethyl phosphate.
Chemical Property Profile of 5-Hydroxypyren-4-yl dimethyl phosphate
Property Insights of 5-Hydroxypyren-4-yl dimethyl phosphate
The XLogP value of 4.1 indicates that 5-Hydroxypyren-4-yl dimethyl phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Hydroxypyren-4-yl dimethyl phosphate. Following Lipinski's Rule of Five, 5-Hydroxypyren-4-yl dimethyl phosphate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Hydroxypyren-4-yl dimethyl phosphate?
The CAS number of 5-Hydroxypyren-4-yl dimethyl phosphate is 150993-62-7.
What is the molecular formula of 5-Hydroxypyren-4-yl dimethyl phosphate?
The molecular formula of 5-Hydroxypyren-4-yl dimethyl phosphate is C18H15O5P.
What is the molecular weight of 5-Hydroxypyren-4-yl dimethyl phosphate?
The molecular weight of 5-Hydroxypyren-4-yl dimethyl phosphate is 342.07 g/mol.
Where can I buy 5-Hydroxypyren-4-yl dimethyl phosphate?
You can request a quote for 5-Hydroxypyren-4-yl dimethyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Hydroxypyren-4-yl dimethyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for 5-Hydroxypyren-4-yl dimethyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.