![[2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid structure](/static/products/1800/18002-79-4.webp)
[2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid
TL;DR: [2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid (CAS 18002-79-4) is a chemical compound with molecular formula C8H8Cl4O6P2 and molecular weight 401.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2,3,5,6-tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid
Also Known As: KST-1A2150, [(2,3,5,6-tetrachlorobenzene-1,4-diyl)dimethanediyl]bis(phosphonic acid), [2,3,5,6-tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid, [(2,3,5,6-Tetrachloro-1,4-phenylene)bis(methylene)]bis(phosphonic acid), Phosphonic acid,[(2,3,5,6-tetrachloro-p-phenylene)dimethylene]di- (8CI)
| Molecular Formula | C8H8Cl4O6P2 |
|---|---|
| Molecular Weight | 401.86 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 401.855 |
| Heavy Atoms | 20 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 18002-79-4 |
|---|---|
| SMILES | C(C1=C(C(=C(C(=C1Cl)Cl)CP(=O)(O)O)Cl)Cl)P(=O)(O)O |
| InChIKey | BFHLSOSJKXMEHX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
[2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid (CAS 18002-79-4), with molecular formula C8H8Cl4O6P2 and molecular weight 401.86 g/mol. IUPAC: [2,3,5,6-tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid.
Chemical Property Profile of [2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid
Property Insights of [2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid. Following Lipinski's Rule of Five, [2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic 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 [2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid?
The CAS number of [2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid is 18002-79-4.
What is the molecular formula of [2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid?
The molecular formula of [2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid is C8H8Cl4O6P2.
What is the molecular weight of [2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid?
The molecular weight of [2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid is 401.86 g/mol.
Where can I buy [2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid?
You can request a quote for [2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid?
Yes, KEHONG BIO provides custom synthesis services for [2,3,5,6-Tetrachloro-4-(phosphonomethyl)phenyl]methylphosphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.