9-(2-(Phosphonomethoxy)ethyl)adenine diphosphate
TL;DR: 9-(2-(Phosphonomethoxy)ethyl)adenine diphosphate (CAS 129532-77-0) is a chemical compound with molecular formula C8H14N5O10P3 and molecular weight 432.99536 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(6-aminopurin-9-yl)ethoxymethyl-[hydroxy(phosphonooxy)phosphoryl]oxyphosphinic acid
Also Known As: PMEApp, adefovir diphosphate, PMEA-DP, 9-(MeOEt)-A-TP, PMEA-pp
Technical Specifications
| Molecular Formula | C8H14N5O10P3 |
| Molecular Weight | 432.99536 g/mol |
| XLogP | -4.2 |
| Topological Polar Surface Area (TPSA) | 229.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 9 |
| Exact Mass | 432.99536 Da |
| Heavy Atoms | 26 |
| Complexity | 632.0 |
| SMILES | C1=NC(=C2C(=N1)N(C=N2)CCOCP(=O)(O)OP(=O)(O)OP(=O)(O)O)N |
| InChIKey | MELHEUHXJKQZNC-UHFFFAOYSA-N |
Chemical Property Profile of 9-(2-(Phosphonomethoxy)ethyl)adenine diphosphate
Property Insights of 9-(2-(Phosphonomethoxy)ethyl)adenine diphosphate
The XLogP value of -4.2 indicates that 9-(2-(Phosphonomethoxy)ethyl)adenine diphosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 229.0 Ų indicates high polarity, suggesting 9-(2-(Phosphonomethoxy)ethyl)adenine diphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 9-(2-(Phosphonomethoxy)ethyl)adenine diphosphate has 5 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 9-(2-(Phosphonomethoxy)ethyl)adenine diphosphate?
The CAS number of 9-(2-(Phosphonomethoxy)ethyl)adenine diphosphate is 129532-77-0.
What is the molecular formula of 9-(2-(Phosphonomethoxy)ethyl)adenine diphosphate?
The molecular formula of 9-(2-(Phosphonomethoxy)ethyl)adenine diphosphate is C8H14N5O10P3.
What is the molecular weight of 9-(2-(Phosphonomethoxy)ethyl)adenine diphosphate?
The molecular weight of 9-(2-(Phosphonomethoxy)ethyl)adenine diphosphate is 432.99536 g/mol.
Where can I buy 9-(2-(Phosphonomethoxy)ethyl)adenine diphosphate?
You can request a quote for 9-(2-(Phosphonomethoxy)ethyl)adenine diphosphate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 9-(2-(Phosphonomethoxy)ethyl)adenine diphosphate?
Yes, CoreyChem provides custom synthesis services for 9-(2-(Phosphonomethoxy)ethyl)adenine diphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.