5-(2-Phosphonoethyl)pyridoxal
TL;DR: 5-(2-Phosphonoethyl)pyridoxal (CAS 32555-98-9) is a chemical compound with molecular formula C9H12NO6P and molecular weight 261.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-formyl-5-hydroxy-6-methyl-3-pyridinyl)ethyl dihydrogen phosphate
Also Known As: 5-(2-Phosphonoethyl)pyridoxal, 1-C5'-Homopyridoxalphosphat, 2-(4-formyl-5-hydroxy-6-methylpyridin-3-yl)ethyl dihydrogen phosphate, 4-Pyridinecarboxaldehyde, 3-hydroxy-2-methyl-5-(2-(phosphonooxy)ethyl)-, RefChem:101630
| Molecular Formula | C9H12NO6P |
|---|---|
| Molecular Weight | 261.04 g/mol |
| LogP | 0.55992 |
| Topological Polar Surface Area | 116.95 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 261.04022 |
| Heavy Atoms | 17 |
| Complexity | 468.79904 |
Chemical Identifiers
| CAS Number | 32555-98-9 |
|---|---|
| SMILES | CC1=NC=C(C(=C1O)C=O)CCOP(=O)(O)O |
Product Overview
5-(2-Phosphonoethyl)pyridoxal (CAS 32555-98-9), with molecular formula C9H12NO6P and molecular weight 261.04 g/mol. IUPAC: 2-(4-formyl-5-hydroxy-6-methyl-3-pyridinyl)ethyl dihydrogen phosphate.
Chemical Property Profile of 5-(2-Phosphonoethyl)pyridoxal
Property Insights of 5-(2-Phosphonoethyl)pyridoxal
The XLogP value of 0.55992 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-Phosphonoethyl)pyridoxal. The TPSA of 116.95 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-Phosphonoethyl)pyridoxal. Following Lipinski's Rule of Five, 5-(2-Phosphonoethyl)pyridoxal has 3 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-(2-Phosphonoethyl)pyridoxal?
The CAS number of 5-(2-Phosphonoethyl)pyridoxal is 32555-98-9.
What is the molecular formula of 5-(2-Phosphonoethyl)pyridoxal?
The molecular formula of 5-(2-Phosphonoethyl)pyridoxal is C9H12NO6P.
What is the molecular weight of 5-(2-Phosphonoethyl)pyridoxal?
The molecular weight of 5-(2-Phosphonoethyl)pyridoxal is 261.04 g/mol.
Where can I buy 5-(2-Phosphonoethyl)pyridoxal?
You can request a quote for 5-(2-Phosphonoethyl)pyridoxal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-Phosphonoethyl)pyridoxal?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-Phosphonoethyl)pyridoxal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.