![[Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid structure](/static/products/1113/1113-55-9.webp)
[Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid
TL;DR: [Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid (CAS 1113-55-9) is a chemical compound with molecular formula C5H13NO6P2S and molecular weight 276.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[phosphono(thiomorpholin-4-yl)methyl]phosphonic acid
Also Known As: Thiomorpholinomethylenediphosphonic Acid, [phosphono(thiomorpholin-4-yl)methyl]phosphonic acid, (thiomorpholin-4-ylmethanediyl)bis(phosphonic acid), 4-thiomorpholinylmethylene-1,1-bisphosphonate, (Thiomorpholinomethylene)bisphosphonic acid
| Molecular Formula | C5H13NO6P2S |
|---|---|
| Molecular Weight | 276.99 g/mol |
| LogP | -5.0 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 276.9939 |
| Heavy Atoms | 15 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 1113-55-9 |
|---|---|
| SMILES | C1CSCCN1C(P(=O)(O)O)P(=O)(O)O |
| InChIKey | RZULBGMWKROXRP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
[Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid (CAS 1113-55-9), with molecular formula C5H13NO6P2S and molecular weight 276.99 g/mol. IUPAC: [phosphono(thiomorpholin-4-yl)methyl]phosphonic acid.
Chemical Property Profile of [Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid
Property Insights of [Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid
The XLogP value of -5.0 indicates that [Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 144.0 Ų indicates high polarity, suggesting [Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid has 4 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 [Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid?
The CAS number of [Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid is 1113-55-9.
What is the molecular formula of [Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid?
The molecular formula of [Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid is C5H13NO6P2S.
What is the molecular weight of [Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid?
The molecular weight of [Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid is 276.99 g/mol.
Where can I buy [Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid?
You can request a quote for [Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid?
Yes, KEHONG BIO provides custom synthesis services for [Phosphono(thiomorpholin-4-yl)methyl]phosphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.