![Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]- structure](/static/products/1185/118552-93-5.webp)
Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]-
TL;DR: Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]- (CAS 118552-93-5) is a chemical compound with molecular formula C8H11BrN5O4P and molecular weight 350.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6-amino-8-bromopurin-9-yl)ethoxymethylphosphonic acid
Also Known As: 4,4'-dicoumarin, 8-Bromo-9-[2-(phosphonomethoxy)ethyl]adenine, 2-(6-amino-8-bromopurin-9-yl)ethoxymethylphosphonic acid, Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]-, 2-(6-amino-8-bromo-purin-9-yl)ethoxymethylphosphonic acid
| Molecular Formula | C8H11BrN5O4P |
|---|---|
| Molecular Weight | 350.97 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 136.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 350.9732 |
| Heavy Atoms | 19 |
| Complexity | 358.0 |
Chemical Identifiers
| CAS Number | 118552-93-5 |
|---|---|
| SMILES | C1=NC(=C2C(=N1)N(C(=N2)Br)CCOCP(=O)(O)O)N |
| InChIKey | OQEILKBTUXZPBJ-UHFFFAOYSA-N |
Product Overview
Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]- (CAS 118552-93-5), with molecular formula C8H11BrN5O4P and molecular weight 350.97 g/mol. IUPAC: 2-(6-amino-8-bromopurin-9-yl)ethoxymethylphosphonic acid.
Chemical Property Profile of Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]-
Property Insights of Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]-
The XLogP value of -1.2 indicates that Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]-. Following Lipinski's Rule of Five, Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]- has 3 hydrogen bond donor(s) and 8 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 Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]-?
The CAS number of Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]- is 118552-93-5.
What is the molecular formula of Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]-?
The molecular formula of Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]- is C8H11BrN5O4P.
What is the molecular weight of Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]-?
The molecular weight of Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]- is 350.97 g/mol.
Where can I buy Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]-?
You can request a quote for Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]-?
Yes, KEHONG BIO provides custom synthesis services for Phosphonic acid, [[2-(6-amino-8-bromo-9H-purin-9-yl)ethoxy]methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.