(2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid
TL;DR: (2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid (CAS 684-17-3) is a chemical compound with molecular formula C2H4Cl3O4P and molecular weight 227.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2,2-trichloro-1-hydroxyethyl)phosphonic acid
Also Known As: Desmethyl trichlorfon, Trichlorfon metabolite, Trichlorfon, demethyl deriv., (2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid, Trichlorohydroxyethyl-phosphonic acid
| Molecular Formula | C2H4Cl3O4P |
|---|---|
| Molecular Weight | 227.89 g/mol |
| LogP | 0.8527 |
| Topological Polar Surface Area | 77.76 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 227.89128 |
| Heavy Atoms | 10 |
| Complexity | 158.37587 |
Chemical Identifiers
| CAS Number | 684-17-3 |
|---|---|
| SMILES | C(C(Cl)(Cl)Cl)(O)P(=O)(O)O |
Product Overview
(2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid (CAS 684-17-3), with molecular formula C2H4Cl3O4P and molecular weight 227.89 g/mol. IUPAC: (2,2,2-trichloro-1-hydroxyethyl)phosphonic acid.
Chemical Property Profile of (2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid
Property Insights of (2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid
The XLogP value of 0.8527 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid. The TPSA of 77.76 Ų falls within the moderate polarity range, balancing permeability and solubility for (2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid. Following Lipinski's Rule of Five, (2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid has 3 hydrogen bond donor(s) and 2 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 (2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid?
The CAS number of (2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid is 684-17-3.
What is the molecular formula of (2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid?
The molecular formula of (2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid is C2H4Cl3O4P.
What is the molecular weight of (2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid?
The molecular weight of (2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid is 227.89 g/mol.
Where can I buy (2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid?
You can request a quote for (2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid?
Yes, KEHONG BIO provides custom synthesis services for (2,2,2-Trichloro-1-hydroxyethyl)phosphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.