Ethyl 2,4-bis(diethoxyphosphoryl)butanoate
TL;DR: Ethyl 2,4-bis(diethoxyphosphoryl)butanoate (CAS 6624-26-6) is a chemical compound with molecular formula C14H30O8P2 and molecular weight 388.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2,4-bis(diethoxyphosphoryl)butanoate
Also Known As: ethyl 2,4-bis(diethoxyphosphoryl)butanoate, J1.093.130D, 2,4-Bis(diethoxyphosphinyl)butyric acid ethyl ester, Butanoic acid,4-bis(diethoxyphosphinyl)-,ethyl ester, Butanoic acid,4-bis(diethoxyphosphinyl)-, ethyl ester
| Molecular Formula | C14H30O8P2 |
|---|---|
| Molecular Weight | 388.14 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 97.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 15 |
| Exact Mass | 388.1416 |
| Heavy Atoms | 24 |
| Complexity | 434.0 |
Chemical Identifiers
| CAS Number | 6624-26-6 |
|---|---|
| SMILES | CCOC(=O)C(CCP(=O)(OCC)OCC)P(=O)(OCC)OCC |
| InChIKey | RDVRYUOPQBOSHR-UHFFFAOYSA-N |
Product Overview
Ethyl 2,4-bis(diethoxyphosphoryl)butanoate (CAS 6624-26-6), with molecular formula C14H30O8P2 and molecular weight 388.14 g/mol. IUPAC: ethyl 2,4-bis(diethoxyphosphoryl)butanoate.
Chemical Property Profile of Ethyl 2,4-bis(diethoxyphosphoryl)butanoate
Property Insights of Ethyl 2,4-bis(diethoxyphosphoryl)butanoate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2,4-bis(diethoxyphosphoryl)butanoate. The TPSA of 97.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2,4-bis(diethoxyphosphoryl)butanoate. Following Lipinski's Rule of Five, Ethyl 2,4-bis(diethoxyphosphoryl)butanoate has 0 hydrogen bond donor(s) and 8 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 Ethyl 2,4-bis(diethoxyphosphoryl)butanoate?
The CAS number of Ethyl 2,4-bis(diethoxyphosphoryl)butanoate is 6624-26-6.
What is the molecular formula of Ethyl 2,4-bis(diethoxyphosphoryl)butanoate?
The molecular formula of Ethyl 2,4-bis(diethoxyphosphoryl)butanoate is C14H30O8P2.
What is the molecular weight of Ethyl 2,4-bis(diethoxyphosphoryl)butanoate?
The molecular weight of Ethyl 2,4-bis(diethoxyphosphoryl)butanoate is 388.14 g/mol.
Where can I buy Ethyl 2,4-bis(diethoxyphosphoryl)butanoate?
You can request a quote for Ethyl 2,4-bis(diethoxyphosphoryl)butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2,4-bis(diethoxyphosphoryl)butanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2,4-bis(diethoxyphosphoryl)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.