1-Diethoxyphosphoryl-2-ethylcyclobutene
TL;DR: 1-Diethoxyphosphoryl-2-ethylcyclobutene (CAS 500545-58-4) is a chemical compound with molecular formula C10H19O3P and molecular weight 218.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-diethoxyphosphoryl-2-ethylcyclobutene
Also Known As: Phosphonicacid, -,diethylester, 1-diethoxyphosphoryl-2-ethylcyclobutene, diethyl(2-ethylcyclobut-1-en-1-yl)phosphonate, Phosphonic acid, (2-ethyl-1-cyclobuten-1-yl)-, diethyl ester (9CI)
| Molecular Formula | C10H19O3P |
|---|---|
| Molecular Weight | 218.11 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 218.10718 |
| Heavy Atoms | 14 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 500545-58-4 |
|---|---|
| SMILES | CCC1=C(CC1)P(=O)(OCC)OCC |
| InChIKey | BNDQEBHAEKUCLM-UHFFFAOYSA-N |
Product Overview
1-Diethoxyphosphoryl-2-ethylcyclobutene (CAS 500545-58-4), with molecular formula C10H19O3P and molecular weight 218.11 g/mol. IUPAC: 1-diethoxyphosphoryl-2-ethylcyclobutene.
Chemical Property Profile of 1-Diethoxyphosphoryl-2-ethylcyclobutene
Property Insights of 1-Diethoxyphosphoryl-2-ethylcyclobutene
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Diethoxyphosphoryl-2-ethylcyclobutene. With a topological polar surface area (TPSA) of 35.5 Ų, 1-Diethoxyphosphoryl-2-ethylcyclobutene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Diethoxyphosphoryl-2-ethylcyclobutene 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 1-Diethoxyphosphoryl-2-ethylcyclobutene?
The CAS number of 1-Diethoxyphosphoryl-2-ethylcyclobutene is 500545-58-4.
What is the molecular formula of 1-Diethoxyphosphoryl-2-ethylcyclobutene?
The molecular formula of 1-Diethoxyphosphoryl-2-ethylcyclobutene is C10H19O3P.
What is the molecular weight of 1-Diethoxyphosphoryl-2-ethylcyclobutene?
The molecular weight of 1-Diethoxyphosphoryl-2-ethylcyclobutene is 218.11 g/mol.
Where can I buy 1-Diethoxyphosphoryl-2-ethylcyclobutene?
You can request a quote for 1-Diethoxyphosphoryl-2-ethylcyclobutene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Diethoxyphosphoryl-2-ethylcyclobutene?
Yes, KEHONG BIO provides custom synthesis services for 1-Diethoxyphosphoryl-2-ethylcyclobutene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.