phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt
TL;DR: phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt (CAS 125674-67-1) is a chemical compound with molecular formula C8H13N4O4P and molecular weight 260.06744 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diazanium;dioxido-oxo-(3-pyridin-4-yl-1,2-oxazol-5-yl)-λ5-phosphane
Also Known As: Diammonium (3-(4-pyridinyl)-5-isoxazolyl)phosphonate, Phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt, Diammonium [3-(pyridin-4-yl)-1,2-oxazol-5-yl]phosphonate, diazanium dioxido-oxo-(3-pyridin-4-yl-1,2-oxazol-5-yl)-
Technical Specifications
| Molecular Formula | C8H13N4O4P |
| Molecular Weight | 260.06744 g/mol |
| XLogP | 0.028 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 260.06744 Da |
| Heavy Atoms | 17 |
| Complexity | 252.0 |
| SMILES | C1=CN=CC=C1C2=NOC(=C2)P(=O)([O-])[O-].[NH4+].[NH4+] |
| InChIKey | BLTNTIYMQWHMFT-UHFFFAOYSA-N |
Chemical Property Profile of phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt
Property Insights of phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt
The XLogP value of 0.028 suggests moderate lipophilicity, balancing water solubility and membrane permeability for phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt. Following Lipinski's Rule of Five, phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt?
The CAS number of phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt is 125674-67-1.
What is the molecular formula of phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt?
The molecular formula of phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt is C8H13N4O4P.
What is the molecular weight of phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt?
The molecular weight of phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt is 260.06744 g/mol.
Where can I buy phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt?
You can request a quote for phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt?
Yes, CoreyChem provides custom synthesis services for phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.