ethyl 3-(diethoxyphosphoryl)prop-2-enoate
TL;DR: ethyl 3-(diethoxyphosphoryl)prop-2-enoate (CAS 995-37-9) is a chemical compound with molecular formula C9H17O5P and molecular weight 236.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (E)-3-diethoxyphosphorylprop-2-enoate
Also Known As: ethyl 3-(diethoxyphosphoryl)prop-2-enoate, ethyl (E)-3-diethoxyphosphorylprop-2-enoate, J1.071.928C, 3-(Diethoxyphosphinyl)acrylic acid ethyl ester
| Molecular Formula | C9H17O5P |
|---|---|
| Molecular Weight | 236.08 g/mol |
| LogP | 2.3293 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 236.08136 |
| Heavy Atoms | 15 |
| Complexity | 251.22832 |
Chemical Identifiers
| CAS Number | 995-37-9 |
|---|---|
| SMILES | CCOC(=O)/C=C/P(=O)(OCC)OCC |
Product Overview
ethyl 3-(diethoxyphosphoryl)prop-2-enoate (CAS 995-37-9), with molecular formula C9H17O5P and molecular weight 236.08 g/mol. IUPAC: ethyl (E)-3-diethoxyphosphorylprop-2-enoate.
Chemical Property Profile of ethyl 3-(diethoxyphosphoryl)prop-2-enoate
Property Insights of ethyl 3-(diethoxyphosphoryl)prop-2-enoate
The XLogP value of 2.3293 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 3-(diethoxyphosphoryl)prop-2-enoate. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3-(diethoxyphosphoryl)prop-2-enoate. Following Lipinski's Rule of Five, ethyl 3-(diethoxyphosphoryl)prop-2-enoate 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 ethyl 3-(diethoxyphosphoryl)prop-2-enoate?
The CAS number of ethyl 3-(diethoxyphosphoryl)prop-2-enoate is 995-37-9.
What is the molecular formula of ethyl 3-(diethoxyphosphoryl)prop-2-enoate?
The molecular formula of ethyl 3-(diethoxyphosphoryl)prop-2-enoate is C9H17O5P.
What is the molecular weight of ethyl 3-(diethoxyphosphoryl)prop-2-enoate?
The molecular weight of ethyl 3-(diethoxyphosphoryl)prop-2-enoate is 236.08 g/mol.
Where can I buy ethyl 3-(diethoxyphosphoryl)prop-2-enoate?
You can request a quote for ethyl 3-(diethoxyphosphoryl)prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 3-(diethoxyphosphoryl)prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-(diethoxyphosphoryl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.