![2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)- structure](/static/products/5564/55642-35-8.webp)
2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)-
TL;DR: 2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)- (CAS 55642-35-8) is a chemical compound with molecular formula C10H19O6P and molecular weight 266.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-diethoxyphosphoryloxybut-2-enoate
Also Known As: 3-2-butenoicacidethylester, ethyl 3-diethoxyphosphoryloxybut-2-enoate, ethyl 3-(diethoxy-phosphoryloxy)but-2-enoate, ethyl 3-[(diethoxyphosphoryl)oxy]but-2-enoate, 2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)-
| Molecular Formula | C10H19O6P |
|---|---|
| Molecular Weight | 266.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 266.09192 |
| Heavy Atoms | 17 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 55642-35-8 |
|---|---|
| SMILES | CCOC(=O)C=C(C)OP(=O)(OCC)OCC |
| InChIKey | JHCCEPMFFLZBLL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)- (CAS 55642-35-8), with molecular formula C10H19O6P and molecular weight 266.09 g/mol. IUPAC: ethyl 3-diethoxyphosphoryloxybut-2-enoate.
Chemical Property Profile of 2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)-
Property Insights of 2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)-
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)-. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)-. Following Lipinski's Rule of Five, 2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)- has 0 hydrogen bond donor(s) and 6 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 2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)-?
The CAS number of 2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)- is 55642-35-8.
What is the molecular formula of 2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)-?
The molecular formula of 2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)- is C10H19O6P.
What is the molecular weight of 2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)-?
The molecular weight of 2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)- is 266.09 g/mol.
Where can I buy 2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)-?
You can request a quote for 2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Butenoic acid, 3-[(diethoxyphosphinyl)oxy]-, ethyl ester, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.