Phosphonic acid, (2,2-dichloro-1-hydroxyvinyl)-, dimethyl ester, acetate
TL;DR: Phosphonic acid, (2,2-dichloro-1-hydroxyvinyl)-, dimethyl ester, acetate (CAS 3566-76-5) is a chemical compound with molecular formula C6H9Cl2O5P and molecular weight 261.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2-dichloro-1-dimethoxyphosphorylethenyl) acetate
Also Known As: Norddeutsche 215, Substanz 215, Substanz 215 [German], 2,2-dichloro-1-(dimethoxyphosphoryl)vinyl acetate, Dimethyl (1-(acetyloxy)-2,2-dichloroethenyl)phosphonate
| Molecular Formula | C6H9Cl2O5P |
|---|---|
| Molecular Weight | 261.96 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 261.95645 |
| Heavy Atoms | 14 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 3566-76-5 |
|---|---|
| SMILES | CC(=O)OC(=C(Cl)Cl)P(=O)(OC)OC |
| InChIKey | MBRBXYPIKYUZFW-UHFFFAOYSA-N |
Product Overview
Phosphonic acid, (2,2-dichloro-1-hydroxyvinyl)-, dimethyl ester, acetate (CAS 3566-76-5), with molecular formula C6H9Cl2O5P and molecular weight 261.96 g/mol. IUPAC: (2,2-dichloro-1-dimethoxyphosphorylethenyl) acetate.
Chemical Property Profile of Phosphonic acid, (2,2-dichloro-1-hydroxyvinyl)-, dimethyl ester, acetate
Property Insights of Phosphonic acid, (2,2-dichloro-1-hydroxyvinyl)-, dimethyl ester, acetate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphonic acid, (2,2-dichloro-1-hydroxyvinyl)-, dimethyl ester, acetate. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphonic acid, (2,2-dichloro-1-hydroxyvinyl)-, dimethyl ester, acetate. Following Lipinski's Rule of Five, Phosphonic acid, (2,2-dichloro-1-hydroxyvinyl)-, dimethyl ester, acetate 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 Phosphonic acid, (2,2-dichloro-1-hydroxyvinyl)-, dimethyl ester, acetate?
The CAS number of Phosphonic acid, (2,2-dichloro-1-hydroxyvinyl)-, dimethyl ester, acetate is 3566-76-5.
What is the molecular formula of Phosphonic acid, (2,2-dichloro-1-hydroxyvinyl)-, dimethyl ester, acetate?
The molecular formula of Phosphonic acid, (2,2-dichloro-1-hydroxyvinyl)-, dimethyl ester, acetate is C6H9Cl2O5P.
What is the molecular weight of Phosphonic acid, (2,2-dichloro-1-hydroxyvinyl)-, dimethyl ester, acetate?
The molecular weight of Phosphonic acid, (2,2-dichloro-1-hydroxyvinyl)-, dimethyl ester, acetate is 261.96 g/mol.
Where can I buy Phosphonic acid, (2,2-dichloro-1-hydroxyvinyl)-, dimethyl ester, acetate?
You can request a quote for Phosphonic acid, (2,2-dichloro-1-hydroxyvinyl)-, dimethyl ester, acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonic acid, (2,2-dichloro-1-hydroxyvinyl)-, dimethyl ester, acetate?
Yes, KEHONG BIO provides custom synthesis services for Phosphonic acid, (2,2-dichloro-1-hydroxyvinyl)-, dimethyl ester, acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.