![Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate structure](/static/products/5865/5865-76-9.webp)
Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate
TL;DR: Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate (CAS 5865-76-9) is a chemical compound with molecular formula C11H17Cl2O7P and molecular weight 362.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-(2,2-dichloro-1-diethoxyphosphorylethenyl)propanedioate
Also Known As: BIM-0036812.P001, dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)vinyl]malonate, Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate, dimethyl 2-(2,2-dichloro-1-diethoxyphosphorylethenyl)propanedioate, dimethyl 2-[2,2-dichloro-1-(diethoxyphosphoryl)vinyl]malonate
| Molecular Formula | C11H17Cl2O7P |
|---|---|
| Molecular Weight | 362.01 g/mol |
| LogP | 2.8614 |
| Topological Polar Surface Area | 88.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 362.00888 |
| Heavy Atoms | 21 |
| Complexity | 433.4881 |
Chemical Identifiers
| CAS Number | 5865-76-9 |
|---|---|
| SMILES | CCOP(=O)(C(=C(Cl)Cl)C(C(=O)OC)C(=O)OC)OCC |
Product Overview
Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate (CAS 5865-76-9), with molecular formula C11H17Cl2O7P and molecular weight 362.01 g/mol. IUPAC: dimethyl 2-(2,2-dichloro-1-diethoxyphosphorylethenyl)propanedioate.
Chemical Property Profile of Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate
Property Insights of Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate
The XLogP value of 2.8614 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate. The TPSA of 88.13 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate. Following Lipinski's Rule of Five, Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate has 0 hydrogen bond donor(s) and 7 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 Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate?
The CAS number of Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate is 5865-76-9.
What is the molecular formula of Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate?
The molecular formula of Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate is C11H17Cl2O7P.
What is the molecular weight of Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate?
The molecular weight of Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate is 362.01 g/mol.
Where can I buy Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate?
You can request a quote for Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl [2,2-dichloro-1-(diethoxyphosphoryl)ethenyl]propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.