Diethyl prop-1-en-1-ylphosphonate
TL;DR: Diethyl prop-1-en-1-ylphosphonate (CAS 5954-65-4) is a chemical compound with molecular formula C7H15O3P and molecular weight 178.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-diethoxyphosphorylprop-1-ene
Also Known As: 1-diethoxyphosphorylprop-1-ene, diethyl prop-1-en-1-ylphosphonate, Fosfomycin Trometamol Impurity 67, (E)-1-diethoxyphosphorylprop-1-ene, Diethyl(prop-2-(E)-enyl)phosphonate
| Molecular Formula | C7H15O3P |
|---|---|
| Molecular Weight | 178.08 g/mol |
| LogP | 2.7861 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 178.07588 |
| Heavy Atoms | 11 |
| Complexity | 155.06862 |
Chemical Identifiers
| CAS Number | 5954-65-4 |
|---|---|
| SMILES | CCOP(=O)(C=CC)OCC |
Product Overview
Diethyl prop-1-en-1-ylphosphonate (CAS 5954-65-4), with molecular formula C7H15O3P and molecular weight 178.08 g/mol. IUPAC: 1-diethoxyphosphorylprop-1-ene.
Chemical Property Profile of Diethyl prop-1-en-1-ylphosphonate
Property Insights of Diethyl prop-1-en-1-ylphosphonate
The XLogP value of 2.7861 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl prop-1-en-1-ylphosphonate. With a topological polar surface area (TPSA) of 35.53 Ų, Diethyl prop-1-en-1-ylphosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl prop-1-en-1-ylphosphonate 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
Frequently Asked Questions
What is the CAS number of Diethyl prop-1-en-1-ylphosphonate?
The CAS number of Diethyl prop-1-en-1-ylphosphonate is 5954-65-4.
What is the molecular formula of Diethyl prop-1-en-1-ylphosphonate?
The molecular formula of Diethyl prop-1-en-1-ylphosphonate is C7H15O3P.
What is the molecular weight of Diethyl prop-1-en-1-ylphosphonate?
The molecular weight of Diethyl prop-1-en-1-ylphosphonate is 178.08 g/mol.
Where can I buy Diethyl prop-1-en-1-ylphosphonate?
You can request a quote for Diethyl prop-1-en-1-ylphosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl prop-1-en-1-ylphosphonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl prop-1-en-1-ylphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.