2-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid
TL;DR: 2-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid (CAS 19730-77-9) is a chemical compound with molecular formula C9H12NO5P and molecular weight 245.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid
Also Known As: 2-[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]ethenylp, 2-[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]ethenylphosphonic acid, {2-[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]ethenyl}phosphonic acid
| Molecular Formula | C9H12NO5P |
|---|---|
| Molecular Weight | 245.05 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 245.0453 |
| Heavy Atoms | 16 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 19730-77-9 |
|---|---|
| SMILES | CC1=NC=C(C(=C1O)CO)C=CP(=O)(O)O |
| InChIKey | DEAVFBYTYRIWQV-UHFFFAOYSA-N |
Product Overview
2-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid (CAS 19730-77-9), with molecular formula C9H12NO5P and molecular weight 245.05 g/mol. IUPAC: 2-[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid.
Chemical Property Profile of 2-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid
Property Insights of 2-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid
The XLogP value of -1.4 indicates that 2-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid. Following Lipinski's Rule of Five, 2-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid has 4 hydrogen bond donor(s) and 6 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 2-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid?
The CAS number of 2-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid is 19730-77-9.
What is the molecular formula of 2-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid?
The molecular formula of 2-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid is C9H12NO5P.
What is the molecular weight of 2-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid?
The molecular weight of 2-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid is 245.05 g/mol.
Where can I buy 2-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid?
You can request a quote for 2-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]ethenylphosphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.