Triethyl 2-phosphonopropionate
TL;DR: Triethyl 2-phosphonopropionate (CAS 3699-66-9) is a chemical compound with molecular formula C9H19O5P and molecular weight 238.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-diethoxyphosphorylpropanoate
Also Known As: Triethyl 2-phosphonopropionate, Ethyl 2-(diethoxyphosphoryl)propanoate, ethyl 2-diethoxyphosphorylpropanoate, triethyl 2-phosphopropionate, Ethyl-2-(diethylphosphono)propanoate
| Molecular Formula | C9H19O5P |
|---|---|
| Molecular Weight | 238.10 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 238.09702 |
| Heavy Atoms | 15 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 3699-66-9 |
|---|---|
| SMILES | CCOC(=O)C(C)P(=O)(OCC)OCC |
| InChIKey | BVSRWCMAJISCTD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Triethyl 2-phosphonopropionate (CAS 3699-66-9), with molecular formula C9H19O5P and molecular weight 238.10 g/mol. IUPAC: ethyl 2-diethoxyphosphorylpropanoate.
Chemical Property Profile of Triethyl 2-phosphonopropionate
Property Insights of Triethyl 2-phosphonopropionate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Triethyl 2-phosphonopropionate. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Triethyl 2-phosphonopropionate. Following Lipinski's Rule of Five, Triethyl 2-phosphonopropionate has 0 hydrogen bond donor(s) and 5 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 Triethyl 2-phosphonopropionate?
The CAS number of Triethyl 2-phosphonopropionate is 3699-66-9.
What is the molecular formula of Triethyl 2-phosphonopropionate?
The molecular formula of Triethyl 2-phosphonopropionate is C9H19O5P.
What is the molecular weight of Triethyl 2-phosphonopropionate?
The molecular weight of Triethyl 2-phosphonopropionate is 238.10 g/mol.
Where can I buy Triethyl 2-phosphonopropionate?
You can request a quote for Triethyl 2-phosphonopropionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Triethyl 2-phosphonopropionate?
Yes, KEHONG BIO provides custom synthesis services for Triethyl 2-phosphonopropionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.