Diethyl (2,2-diethoxyethyl)phosphonate
TL;DR: Diethyl (2,2-diethoxyethyl)phosphonate (CAS 7598-61-0) is a chemical compound with molecular formula C10H23O5P and molecular weight 254.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-diethoxyphosphoryl-1,1-diethoxyethane
Also Known As: Diethyl (2,2-diethoxyethyl)phosphonate, Diethyl 2,2-diethoxyethylphosphonate, diethyl(2,2-diethoxyethyl)phosphonate, Diethyl 2,2-Diethoxethylphosphonate, 2-diethoxyphosphoryl-1,1-diethoxyethane
| Molecular Formula | C10H23O5P |
|---|---|
| Molecular Weight | 254.13 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 254.12831 |
| Heavy Atoms | 16 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 7598-61-0 |
|---|---|
| SMILES | CCOC(CP(=O)(OCC)OCC)OCC |
| InChIKey | LUQYELQXRPNKRY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diethyl (2,2-diethoxyethyl)phosphonate (CAS 7598-61-0), with molecular formula C10H23O5P and molecular weight 254.13 g/mol. IUPAC: 2-diethoxyphosphoryl-1,1-diethoxyethane.
Chemical Property Profile of Diethyl (2,2-diethoxyethyl)phosphonate
Property Insights of Diethyl (2,2-diethoxyethyl)phosphonate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl (2,2-diethoxyethyl)phosphonate. With a topological polar surface area (TPSA) of 54.0 Ų, Diethyl (2,2-diethoxyethyl)phosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl (2,2-diethoxyethyl)phosphonate 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 Diethyl (2,2-diethoxyethyl)phosphonate?
The CAS number of Diethyl (2,2-diethoxyethyl)phosphonate is 7598-61-0.
What is the molecular formula of Diethyl (2,2-diethoxyethyl)phosphonate?
The molecular formula of Diethyl (2,2-diethoxyethyl)phosphonate is C10H23O5P.
What is the molecular weight of Diethyl (2,2-diethoxyethyl)phosphonate?
The molecular weight of Diethyl (2,2-diethoxyethyl)phosphonate is 254.13 g/mol.
Where can I buy Diethyl (2,2-diethoxyethyl)phosphonate?
You can request a quote for Diethyl (2,2-diethoxyethyl)phosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl (2,2-diethoxyethyl)phosphonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl (2,2-diethoxyethyl)phosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.