Ethyl phosphonoformate
TL;DR: Ethyl phosphonoformate (CAS 102831-46-9) is a chemical compound with molecular formula C3H5Cl2O3P and molecular weight 189.93533 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl dichlorophosphorylformate
Also Known As: ethylphosphonoformate, ethyl phosphonoformate, Ethyl Dichlorophosphorylformate, ethyl dichlorophosphinecarboxylate oxide
Technical Specifications
| Molecular Formula | C3H5Cl2O3P |
| Molecular Weight | 189.93533 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 189.93533 Da |
| Heavy Atoms | 9 |
| Complexity | 151.0 |
| SMILES | CCOC(=O)P(=O)(Cl)Cl |
| InChIKey | MPTKFBJYKPUIGE-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl phosphonoformate
Property Insights of Ethyl phosphonoformate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl phosphonoformate. With a topological polar surface area (TPSA) of 43.4 Ų, Ethyl phosphonoformate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl phosphonoformate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl phosphonoformate?
The CAS number of Ethyl phosphonoformate is 102831-46-9.
What is the molecular formula of Ethyl phosphonoformate?
The molecular formula of Ethyl phosphonoformate is C3H5Cl2O3P.
What is the molecular weight of Ethyl phosphonoformate?
The molecular weight of Ethyl phosphonoformate is 189.93533 g/mol.
Where can I buy Ethyl phosphonoformate?
You can request a quote for Ethyl phosphonoformate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl phosphonoformate?
Yes, CoreyChem provides custom synthesis services for Ethyl phosphonoformate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.