Diethyl P-(2,2,2-trichloro-1-hydroxyethyl)phosphonate
TL;DR: Diethyl P-(2,2,2-trichloro-1-hydroxyethyl)phosphonate (CAS 993-86-2) is a chemical compound with molecular formula C6H12Cl3O4P and molecular weight 283.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trichloro-1-diethoxyphosphorylethanol
Also Known As: Trichlorfon ethyl, Ethyl trichlorfon, Ethyl Dipterex, Ethyltrichlorphon, Ethyl chlorophos
| Molecular Formula | C6H12Cl3O4P |
|---|---|
| Molecular Weight | 283.95 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 283.9539 |
| Heavy Atoms | 14 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 993-86-2 |
|---|---|
| SMILES | CCOP(=O)(C(C(Cl)(Cl)Cl)O)OCC |
| InChIKey | FGQNUVIUWZJVCR-UHFFFAOYSA-N |
Product Overview
Diethyl P-(2,2,2-trichloro-1-hydroxyethyl)phosphonate (CAS 993-86-2), with molecular formula C6H12Cl3O4P and molecular weight 283.95 g/mol. IUPAC: 2,2,2-trichloro-1-diethoxyphosphorylethanol.
Chemical Property Profile of Diethyl P-(2,2,2-trichloro-1-hydroxyethyl)phosphonate
Property Insights of Diethyl P-(2,2,2-trichloro-1-hydroxyethyl)phosphonate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl P-(2,2,2-trichloro-1-hydroxyethyl)phosphonate. With a topological polar surface area (TPSA) of 55.8 Ų, Diethyl P-(2,2,2-trichloro-1-hydroxyethyl)phosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl P-(2,2,2-trichloro-1-hydroxyethyl)phosphonate has 1 hydrogen bond donor(s) and 4 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 Diethyl P-(2,2,2-trichloro-1-hydroxyethyl)phosphonate?
The CAS number of Diethyl P-(2,2,2-trichloro-1-hydroxyethyl)phosphonate is 993-86-2.
What is the molecular formula of Diethyl P-(2,2,2-trichloro-1-hydroxyethyl)phosphonate?
The molecular formula of Diethyl P-(2,2,2-trichloro-1-hydroxyethyl)phosphonate is C6H12Cl3O4P.
What is the molecular weight of Diethyl P-(2,2,2-trichloro-1-hydroxyethyl)phosphonate?
The molecular weight of Diethyl P-(2,2,2-trichloro-1-hydroxyethyl)phosphonate is 283.95 g/mol.
Where can I buy Diethyl P-(2,2,2-trichloro-1-hydroxyethyl)phosphonate?
You can request a quote for Diethyl P-(2,2,2-trichloro-1-hydroxyethyl)phosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl P-(2,2,2-trichloro-1-hydroxyethyl)phosphonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl P-(2,2,2-trichloro-1-hydroxyethyl)phosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.